Vitas-M small molecule compound
methyl 4-({(Z)-[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Catalog ID
STL171022
SMILES COC(=O)c1ccc(cc1)N/C=C\1/C(=NN(C1=O)c1cccc(c1)Cl)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 C19H16ClN3O3 MW 369.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16ClN3O3/c1-12-17(11-21-15-8-6-13(7-9-15)19(25)26-2)18(24)23(22-12)16-5-3-4-14(20)10-16/h3-11,21H,1-2H3/b17-11-InChIKey
KRQBZSHPIYCRIY-BOPFTXTBSA-NSynonyms
354994-92-6354994926
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)C(=O)OC)C3=CC(=CC=C3)Cl
COC(=O)c1ccc(cc1)NC=C1C(=NN(C1=O)c1cccc(c1)Cl)C
InChI=1SC19H16ClN3O3c11217(1121158613(7915)19(25)262)18(24)23(2212)1653414(20)1016h31121H12H3b1711
methyl4(((Z)(1(3chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoate
METHYL4(((Z)(1(3CHLOROPHENYL)3METHYL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
MFCD01178613
ZINC000015930149
ZINC15930149
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