Vitas-M small molecule compound
N-(4-chlorophenyl)-7-(4-fluorophenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STL200342
SMILES CSc1nc2n(n1)C(c1ccc(cc1)F)C(=C(N2)C)C(=O)Nc1ccc(cc1)Cl
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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 C20H17ClFN5OS MW 429.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClFN5OS/c1-11-16(18(28)24-15-9-5-13(21)6-10-15)17(12-3-7-14(22)8-4-12)27-19(23-11)25-20(26-27)29-2/h3-10,17H,1-2H3,(H,24,28)(H,23,25,26)InChIKey
TZVOHSNURPUJDL-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=C(N2)SC)C3=CC=C(C=C3)F)C(=O)NC4=CC=C(C=C4)Cl
InChI=1SC20H17ClFN5OSc11116(18(28)24159513(21)61015)17(123714(22)8412)2719(2311)2520(2627)292h31017H12H3(H2428)(H232526)
MFCD14730166
N(4CHLOROPHENYL)2(METHYLTHIO)5METHYL7(4FLUOROPHENYL)47DIHYDRO(124)TRIAZOLO(23A)PYRIMIDINE6CARBOXAMIDE
N(4chlorophenyl)7(4fluorophenyl)5methyl2(methylsulfanyl)47dihydro(124)triazolo(15a)pyrimidine6carboxamide
N(4chlorophenyl)7(4fluorophenyl)5methyl2methylsulfanyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
ZINC000009942348
ZINC000009942350
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