Vitas-M small molecule compound
2-(benzylsulfanyl)-N-(4-oxo-2-sulfanyl-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Catalog ID
STK440454
SMILES O=C(Nn1c(S)nc2c(c1=O)c1CCCCc1s2)CSCc1ccccc1
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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 C19H19N3O2S3 MW 417.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O2S3/c23-15(11-26-10-12-6-2-1-3-7-12)21-22-18(24)16-13-8-4-5-9-14(13)27-17(16)20-19(22)25/h1-3,6-7H,4-5,8-11H2,(H,20,25)(H,21,23)InChIKey
KKQPNLJKYQQMQD-UHFFFAOYSA-NSynonyms
2(benzylsulfanyl)N(4oxo2sulfanyl5678tetrahydro(1)benzothieno(23d)pyrimidin3(4H)yl)acetamide
2benzylsulfanylN(4oxo2sulfanylidene5678tetrahydro1H(1)benzothiolo(23d)pyrimidin3yl)acetamide
C1CCC2=C(C1)C3=C(S2)NC(=S)N(C3=O)NC(=O)CSCC4=CC=CC=C4
InChI=1SC19H19N3O2S3c2315(112610126213712)212218(24)1613845914(13)2717(16)2019(22)25h1367H45811H2(H2025)(H2123)
MFCD03946232
ZINC000017091197
ZINC17091197
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