Vitas-M small molecule compound
propyl 2-chloro-5-({(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Catalog ID
STK957527
SMILES CCCOC(=O)c1cc(N/C=C\2/C(=NN(C2=O)c2ccc(cc2)Cl)C)ccc1Cl
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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 C21H19Cl2N3O3 MW 432.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Cl2N3O3/c1-3-10-29-21(28)17-11-15(6-9-19(17)23)24-12-18-13(2)25-26(20(18)27)16-7-4-14(22)5-8-16/h4-9,11-12,24H,3,10H2,1-2H3/b18-12-InChIKey
DUMFVJKCNCKGGH-PDGQHHTCSA-NSynonyms
352684-31-2352684312
CCCOC(=O)C1=C(C=CC(=C1)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)Cl)C)Cl
CCCOC(=O)c1cc(NC=C2C(=NN(C2=O)c2ccc(cc2)Cl)C)ccc1Cl
InChI=1SC21H19Cl2N3O3c13102921(28)171115(6919(17)23)24121813(2)2526(20(18)27)167414(22)5816h49111224H310H212H3b1812
MFCD01178530
PROPYL2CHLORO5(((1(4CHLOROPHENYL)3METHYL5OXO15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
propyl2chloro5(((Z)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoate
propyl2chloro5(((Z)(1(4chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)benzoate
ZINC000008430538
ZINC08430538
ZINC8430538
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