Vitas-M small molecule compound
ethyl 7-(4-fluorophenyl)-5-methyl-2-[(3-methylbenzyl)sulfanyl]-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK217676
SMILES CCOC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)F)nc(n2)SCc1cccc(c1)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 C23H23FN4O2S MW 438.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23FN4O2S/c1-4-30-21(29)19-15(3)25-22-26-23(31-13-16-7-5-6-14(2)12-16)27-28(22)20(19)17-8-10-18(24)11-9-17/h5-12,20H,4,13H2,1-3H3,(H,25,26,27)InChIKey
MXCQOUBWDTUHGV-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N=C(NN2C1C3=CC=C(C=C3)F)SCC4=CC=CC(=C4)C)C
ethyl7(4fluorophenyl)5methyl2((3methylbenzyl)sulfanyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ETHYL7(4FLUOROPHENYL)5METHYL2((3METHYLPHENYL)METHYLSULFANYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7(4FLUOROPHENYL)5METHYL2((3METHYLPHENYL)METHYLTHIO)478TRIHYDRO124TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H23FN4O2Sc143021(29)1915(3)25222623(31131675614(2)1216)2728(22)20(19)1781018(24)11917h51220H413H213H3(H252627)
MFCD06611536
ZINC000009608632
ZINC000009608636
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