Vitas-M small molecule compound
N-(2-ethyl-6-methylphenyl)-2-{[3-(furan-2-ylmethyl)-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL339333
SMILES CCc1cccc(c1NC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccco1)CCCC3)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 C26H27N3O3S2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S2/c1-3-17-9-6-8-16(2)23(17)27-21(30)15-33-26-28-24-22(19-11-4-5-12-20(19)34-24)25(31)29(26)14-18-10-7-13-32-18/h6-10,13H,3-5,11-12,14-15H2,1-2H3,(H,27,30)InChIKey
WDWBNPVNVIFMNC-UHFFFAOYSA-NSynonyms
760964-64-5760964645
CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(C4=C(S3)CCCC4)C(=O)N2CC5=CC=CO5)C
InChI=1SC26H27N3O3S2c131796816(2)23(17)2721(30)153326282422(1911451220(19)3424)25(31)29(26)1418107133218h61013H3511121415H212H3(H2730)
MFCD04010563
N(2ethyl6methylphenyl)2((3(furan2ylmethyl)4oxo345678hexahydro(1)benzothieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(2ethyl6methylphenyl)2((3(furan2ylmethyl)4oxo345678hexahydrobenzo(45)thieno(23d)pyrimidin2yl)thio)acetamide
N(2ethyl6methylphenyl)2((3(furan2ylmethyl)4oxo5678tetrahydro(1)benzothiolo(23d)pyrimidin2yl)sulfanyl)acetamide
ZINC000002359195
ZINC02359195
ZINC2359195
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