Vitas-M small molecule compound

6-methyl-2-{[(pyrimidin-2-ylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STK474522
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)CSc1ncccn1

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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 C16H18N4O2S2 MW 362.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O2S2/c1-9-3-4-10-11(7-9)24-15(13(10)14(17)22)20-12(21)8-23-16-18-5-2-6-19-16/h2,5-6,9H,3-4,7-8H2,1H3,(H2,17,22)(H,20,21)
InChIKey
GBGDYTQSBZHSNC-UHFFFAOYSA-N
Synonyms

6methyl2(((pyrimidin2ylsulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxamide
6methyl2((2pyrimidin2ylsulfanylacetyl)amino)4567tetrahydro1benzothiophene3carboxamide
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=NC=CC=N3
InChI=1SC16H18N4O2S2c19341011(79)2415(13(10)14(17)22)2012(21)82316185261916h2569H3478H21H3(H21722)(H2021)
MFCD06079301
ZINC000006727012
ZINC000006727013

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Available files

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