Vitas-M small molecule compound

2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide

Catalog ID
STK127817
SMILES N#Cc1c(NC(=O)CSc2nc3c(o2)cccc3)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 C18H15N3O2S2 MW 369.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N3O2S2/c19-9-12-11-5-1-4-8-15(11)25-17(12)21-16(22)10-24-18-20-13-6-2-3-7-14(13)23-18/h2-3,6-7H,1,4-5,8,10H2,(H,21,22)
InChIKey
AZDKONHNHUWETA-UHFFFAOYSA-N
Synonyms
313481-45-7
2(13benzoxazol2ylsulfanyl)N(3cyano4567tetrahydro1benzothiophen2yl)acetamide
2(benzo(d)oxazol2ylthio)N(3cyano4567tetrahydrobenzo(b)thiophen2yl)acetamide
313481457
C1CCC2=C(C1)C(=C(S2)NC(=O)CSC3=NC4=CC=CC=C4O3)C#N
InChI=1SC18H15N3O2S2c1991211514815(11)2517(12)2116(22)1024182013623714(13)2318h2367H145810H2(H2122)
MFCD01044401
ZINC000004700346
ZINC04700346
ZINC4700346

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Available files

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