Vitas-M small molecule compound
[(3-benzyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
Catalog ID
STK060337
SMILES OC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3
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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 C19H18N2O3S2 MW 386.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O3S2/c22-15(23)11-25-19-20-17-16(13-8-4-5-9-14(13)26-17)18(24)21(19)10-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,22,23)InChIKey
OELBXBPVWGMVAY-UHFFFAOYSA-NSynonyms
331964-33-1((3benzyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)aceticacid
2((3benzyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)aceticacid
2((3benzyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)aceticacid
331964331
C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)CC4=CC=CC=C4)SCC(=O)O
InChI=1SC19H18N2O3S2c2215(23)112519201716(13845914(13)2617)18(24)21(19)10126213712h1367H45811H2(H2223)
MFCD01455879
OC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCC3
STK060337
ZINC000004813962
ZINC4813962
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