Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

Catalog ID
STK331194
SMILES N#Cc1c(NC(=O)c2c(C)onc2c2ccccc2)sc2c1CCCC2

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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 C20H17N3O2S MW 363.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O2S/c1-12-17(18(23-25-12)13-7-3-2-4-8-13)19(24)22-20-15(11-21)14-9-5-6-10-16(14)26-20/h2-4,7-8H,5-6,9-10H2,1H3,(H,22,24)
InChIKey
VEBXBONIIXZWPN-UHFFFAOYSA-N
Synonyms

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC20H17N3O2Sc11217(18(232512)137324813)19(24)222015(1121)149561016(14)2620h2478H56910H21H3(H2224)
MFCD01342167
N(3cyano4567tetrahydro1benzothiophen2yl)5methyl3phenyl12oxazole4carboxamide
ZINC000004181588
ZINC04181588
ZINC4181588

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.