Vitas-M small molecule compound
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(2-nitrophenyl)acetamide
Catalog ID
STK465518
SMILES N#Cc1c(NC(=O)Cc2ccccc2[N+](=O)[O-])sc2c1CCCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c19-11-14-13-7-2-1-3-9-16(13)25-18(14)20-17(22)10-12-6-4-5-8-15(12)21(23)24/h4-6,8H,1-3,7,9-10H2,(H,20,22)InChIKey
FXEGWKIVKJXNFE-UHFFFAOYSA-NSynonyms
C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CC3=CC=CC=C3(N+)(=O)(O)
InChI=1SC18H17N3O3Sc191114137213916(13)2518(14)2017(22)1012645815(12)21(23)24h468H137910H2(H2022)
MFCD06624891
N#Cc1c(NC(=O)Cc2ccccc2(N+)(=O)(O))sc2c1CCCCC2
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(2nitrophenyl)acetamide
ZINC000002872664
ZINC02872664
ZINC2872664
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