Vitas-M small molecule compound
[(3-benzyl-7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetic acid
Catalog ID
STK524868
SMILES OC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCC(C3)C(C)(C)C
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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 C23H26N2O3S2 MW 442.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O3S2/c1-23(2,3)15-9-10-16-17(11-15)30-20-19(16)21(28)25(12-14-7-5-4-6-8-14)22(24-20)29-13-18(26)27/h4-8,15H,9-13H2,1-3H3,(H,26,27)InChIKey
LCWZEQYPQQOJQJ-UHFFFAOYSA-NSynonyms
354992-68-0((3benzyl7tertbutyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)aceticacid
2((3benzyl7(tertbutyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)aceticacid
2((3benzyl7tertbutyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)aceticacid
354992680
CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)O)CC4=CC=CC=C4
InChI=1SC23H26N2O3S2c123(23)159101617(1115)302019(16)21(28)25(12147546814)22(2420)291318(26)27h4815H913H213H3(H2627)
MFCD01875574
ZINC000002183455
ZINC000002183456
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