Vitas-M small molecule compound
2-[(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]-N-{2-[(naphthalen-1-ylmethyl)sulfanyl]-1,3-benzothiazol-6-yl}acetamide
Catalog ID
STK544664
SMILES O=C(Nc1ccc2c(c1)sc(n2)SCc1cccc2c1cccc2)CSc1nc2sc3c(c2c(=O)n1C)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 C31H26N4O2S4 MW 614.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26N4O2S4/c1-35-29(37)27-22-11-4-5-12-24(22)40-28(27)34-30(35)38-17-26(36)32-20-13-14-23-25(15-20)41-31(33-23)39-16-19-9-6-8-18-7-2-3-10-21(18)19/h2-3,6-10,13-15H,4-5,11-12,16-17H2,1H3,(H,32,36)InChIKey
KPMRSQLMNHJQDI-UHFFFAOYSA-NSynonyms
2((3methyl4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)N(2((naphthalen1ylmethyl)sulfanyl)13benzothiazol6yl)acetamide
2((3methyl4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)N(2((naphthalen1ylmethyl)thio)benzo(d)thiazol6yl)acetamide
2((3methyl4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)N(2(naphthalen1ylmethylsulfanyl)13benzothiazol6yl)acetamide
CN1C(=O)C2=C(N=C1SCC(=O)NC3=CC4=C(C=C3)N=C(S4)SCC5=CC=CC6=CC=CC=C65)SC7=C2CCCC7
InChI=1SC31H26N4O2S4c13529(37)272211451224(22)4028(27)3430(35)381726(36)322013142325(1520)4131(3323)391619968187231021(18)19h236101315H4511121617H21H3(H3236)
MFCD02326134
ZINC000102439066
ZINC102439066
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