Vitas-M small molecule compound
N-(4-chloro-2-fluorophenyl)-2-[(6-methyl-4-oxo-3-phenyl-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Catalog ID
STL093388
SMILES O=C(Nc1ccc(cc1F)Cl)CSc1nc2cc([nH]c2c(=O)n1c1ccccc1)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 C21H16ClFN4O2S MW 442.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClFN4O2S/c1-12-9-17-19(24-12)20(29)27(14-5-3-2-4-6-14)21(26-17)30-11-18(28)25-16-8-7-13(22)10-15(16)23/h2-10,24H,11H2,1H3,(H,25,28)InChIKey
AMOQYAWRAPDPIB-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=C(C=C(C=C3)Cl)F)C4=CC=CC=C4
InChI=1SC21H16ClFN4O2Sc11291719(2412)20(29)27(145324614)21(2617)301118(28)25168713(22)1015(16)23h21024H11H21H3(H2528)
MFCD18787522
N(4chloro2fluorophenyl)2((6methyl4oxo3phenyl45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4chloro2fluorophenyl)2((6methyl4oxo3phenyl5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
O=C(Nc1ccc(cc1F)Cl)CSc1nc2cc((nH)c2c(=O)n1c1ccccc1)C
ZINC000067236765
ZINC67236765
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