Vitas-M small molecule compound
propan-2-yl 7-(4-chlorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL181651
SMILES CC(OC(=O)C1=C(C)Nc2n(C1c1ccc(cc1)Cl)ncn2)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 C16H17ClN4O2 MW 332.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O2/c1-9(2)23-15(22)13-10(3)20-16-18-8-19-21(16)14(13)11-4-6-12(17)7-5-11/h4-9,14H,1-3H3,(H,18,19,20)InChIKey
ATFQUAPQWHRSIV-UHFFFAOYSA-NSynonyms
462070-01-5462070015
CC1=C(C(N2C(=N1)N=CN2)C3=CC=C(C=C3)Cl)C(=O)OC(C)C
InChI=1SC16H17ClN4O2c19(2)2315(22)1310(3)20161881921(16)14(13)114612(17)7511h4914H13H3(H181920)
ISOPROPYL7(4CHLOROPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
MFCD03268081
PROPAN2YL7(4CHLOROPHENYL)5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
propan2yl7(4chlorophenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ZINC000000132116
ZINC000000132119
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