Vitas-M small molecule compound
methyl 7-(4-chlorophenyl)-5-methyl-2-(methylsulfanyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK980389
SMILES COC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)Cl)nc(n2)SC
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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 C15H15ClN4O2S MW 350.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN4O2S/c1-8-11(13(21)22-2)12(9-4-6-10(16)7-5-9)20-14(17-8)18-15(19-20)23-3/h4-7,12H,1-3H3,(H,17,18,19)InChIKey
NGVACBZRHGJRNN-UHFFFAOYSA-NSynonyms
725218-14-4725218144
CC1=C(C(N2C(=N1)N=C(N2)SC)C3=CC=C(C=C3)Cl)C(=O)OC
InChI=1SC15H15ClN4O2Sc1811(13(21)222)12(94610(16)759)2014(178)1815(1920)233h4712H13H3(H171819)
methyl7(4chlorophenyl)5methyl2(methylsulfanyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
METHYL7(4CHLOROPHENYL)5METHYL2(METHYLTHIO)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
METHYL7(4CHLOROPHENYL)5METHYL2METHYLSULFANYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
MFCD04227838
ZINC000001064916
ZINC000001064919
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