avitriptan (Q4829012)

Avitriptan (English)

14 October 2016

C₂₂H₃₀N₆O₃S

1 reference

Avitriptan (English)

14 October 2016

CNS(=O)(=O)CC1=CC2=C(C=C1)NC=C2CCCN3CCN(CC3)C4=NC=NC=C4OC

1 reference

InChI=1S/C22H30N6O3S/c1-23-32(29,30)15-17-5-6-20-19(12-17)18(13-25-20)4-3-7-27-8-10-28(11-9-27)22-21(31-2)14-24-16-26-22/h5-6,12-14,16,23,25H,3-4,7-11,15H2,1-2H3

Avitriptan (English)

14 October 2016

Avitriptan

0 references

Identifiers

InChI

1 reference

Avitriptan (English)

14 October 2016

1 reference

Global Substance Registration System

Avitriptan (English)

14 October 2016

2 references

UNII

6RS056L04P

avitriptan (English)

14 October 2016

https://commonchemistry.cas.org/detail?cas_rn=151140-96-4

9 April 2021

1 reference

avitriptan (English)

14 October 2016

2 references

English

title

Avitriptan (English)

retrieved

14 October 2016

ChEBI ID

177844

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C22H30N6O3S/c1-23-32(29,30)15-17-5-6-20-19(12-17)18(13-25-20)4-3-7-27-8-10-28(11-9-27)22-21(31-2)14-24-16-26-22/h5-6,12-14,16,23,25H,3-4,7-11,15H2,1-2H3

1 reference

AVITRIPTAN (English)

14 October 2016

2 references

inferred from InChIKey

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

1 reference

2 references

DSSTOX compound identifier

DTXCID3087209

0 references

Guide to Pharmacology Ligand ID

10446

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

retrieved

5 February 2021

Human Metabolome Database ID

HMDB0248744

2 references

based on heuristic

inferred from InChIKey

Global Substance Registration System

UNII

6RS056L04P

2 references

stated in

UNII

6RS056L04P

English

title

avitriptan (English)

retrieved

14 October 2016