Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[3-(4-chlorophenyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL338630
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nc2sc3c(c2c(=O)n1c1ccc(cc1)Cl)CCC3
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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 C24H18ClN3O4S2 MW 512.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN3O4S2/c25-13-4-7-15(8-5-13)28-23(30)21-16-2-1-3-19(16)34-22(21)27-24(28)33-11-20(29)26-14-6-9-17-18(10-14)32-12-31-17/h4-10H,1-3,11-12H2,(H,26,29)InChIKey
FFKWLWVNHJETPN-UHFFFAOYSA-NSynonyms
676580-01-1676580011
C1CC2=C(C1)SC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC5=C(C=C4)OCO5)C6=CC=C(C=C6)Cl
InChI=1SC24H18ClN3O4S2c25134715(8513)2823(30)211621319(16)3422(21)2724(28)331120(29)2614691718(1014)32123117h410H131112H2(H2629)
MFCD03224717
N(13benzodioxol5yl)2((2(4chlorophenyl)1oxo78dihydro6Hcyclopenta(23)thieno(24b)pyrimidin3yl)sulfanyl)acetamide
N(13benzodioxol5yl)2((3(4chlorophenyl)4oxo3567tetrahydro4Hcyclopenta(45)thieno(23d)pyrimidin2yl)sulfanyl)acetamide
N(benzo(d)(13)dioxol5yl)2((3(4chlorophenyl)4oxo4567tetrahydro3Hcyclopenta(45)thieno(23d)pyrimidin2yl)thio)acetamide
ZINC000000731842
ZINC00731842
ZINC731842
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