Vitas-M small molecule compound
4-[2-(4-chlorophenyl)-3-oxotetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazol-1-yl]benzonitrile
Catalog ID
STK598473
SMILES N#Cc1ccc(cc1)C1N(c2ccc(cc2)Cl)C(=O)N2N1CCC2
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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 C18H15ClN4O MW 338.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN4O/c19-15-6-8-16(9-7-15)23-17(14-4-2-13(12-20)3-5-14)21-10-1-11-22(21)18(23)24/h2-9,17H,1,10-11H2InChIKey
CBVCWGJAZBAFHA-UHFFFAOYSA-NSynonyms
900898-96-64(2(4chlorophenyl)3oxo1567tetrahydropyrazolo(12a)(124)triazol1yl)benzonitrile
4(2(4chlorophenyl)3oxohexahydropyrazolo(12a)(124)triazol1yl)benzonitrile
4(2(4chlorophenyl)3oxotetrahydro1H5Hpyrazolo(12a)(124)triazol1yl)benzonitrile
900898966
C1CN2C(N(C(=O)N2C1)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)C#N
InChI=1SC18H15ClN4Oc19156816(9715)2317(144213(1220)3514)211011122(21)18(23)24h2917H11011H2
MFCD06779905
ZINC000005307317
ZINC000005307320
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