Vitas-M small molecule compound
2-{[3-(3,4-dichlorophenyl)-5,6-dimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-(4-nitrophenyl)acetamide
Catalog ID
STK543988
SMILES O=C(Nc1ccc(cc1)[N+](=O)[O-])CSc1nc2sc(c(c2c(=O)n1c1ccc(c(c1)Cl)Cl)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 C22H16Cl2N4O4S2 MW 535.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl2N4O4S2/c1-11-12(2)34-20-19(11)21(30)27(15-7-8-16(23)17(24)9-15)22(26-20)33-10-18(29)25-13-3-5-14(6-4-13)28(31)32/h3-9H,10H2,1-2H3,(H,25,29)InChIKey
GIODCNNDPNFBEU-UHFFFAOYSA-NSynonyms
380474-60-22((3(34dichlorophenyl)56dimethyl4oxo34dihydrothieno(23d)pyrimidin2yl)sulfanyl)N(4nitrophenyl)acetamide
2((3(34dichlorophenyl)56dimethyl4oxo34dihydrothieno(23d)pyrimidin2yl)thio)N(4nitrophenyl)acetamide
2(3(34DICHLOROPHENYL)56DIMETHYL4OXOTHIENO(23D)PYRIMIDIN2YL)SULFANYLN(4NITROPHENYL)ACETAMIDE
380474602
CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)(N+)(=O)(O))C4=CC(=C(C=C4)Cl)Cl)C
InChI=1SC22H16Cl2N4O4S2c11112(2)342019(11)21(30)27(157816(23)17(24)915)22(2620)331018(29)25133514(6413)28(31)32h39H10H212H3(H2529)
MFCD03154925
O=C(Nc1ccc(cc1)(N+)(=O)(O))CSc1nc2sc(c(c2c(=O)n1c1ccc(c(c1)Cl)Cl)C)C
ZINC000097951661
ZINC97951661
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