Vitas-M small molecule compound
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-{[1-(3-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Catalog ID
STK337895
SMILES COc1cccc(c1)n1nnnc1SCC(=O)Nc1sc2c(c1C#N)CCCC2
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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 C19H18N6O2S2 MW 426.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N6O2S2/c1-27-13-6-4-5-12(9-13)25-19(22-23-24-25)28-11-17(26)21-18-15(10-20)14-7-2-3-8-16(14)29-18/h4-6,9H,2-3,7-8,11H2,1H3,(H,21,26)InChIKey
UURZXUBHWVJTJH-UHFFFAOYSA-NSynonyms
878700-66-4878700664
COC1=CC=CC(=C1)N2C(=NN=N2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N
InChI=1SC19H18N6O2S2c1271364512(913)2519(22232425)281117(26)211815(1020)14723816(14)2918h469H237811H21H3(H2126)
MFCD06431823
N(3cyano4567tetrahydro1benzothiophen2yl)2((1(3methoxyphenyl)1Htetrazol5yl)sulfanyl)acetamide
N(3cyano4567tetrahydro1benzothiophen2yl)2(1(3methoxyphenyl)tetrazol5yl)sulfanylacetamide
ZINC000010382190
ZINC10382190
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