ethyl 5-[[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methyl-amino]methyl]-1-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methyl-amino]methyl]-1-(1-methyl-2-oxidanylidene-quinolin-4-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methyl-amino]methyl]-1-(1-methyl-2-oxo-4-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methylamino]methyl]-1-(1-methyl-2-oxo-4-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methylamino]methyl]-1-(1-methyl-2-oxoquinolin-4-yl)pyrazole-4-carboxylate Traditional Name: 5-[[1-(3,5-dimethyl-1H-pyrazol-4-yl)ethyl-methyl-amino]methyl]-1-(2-keto-1-methyl-4-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C25H30N6O3 MolecularWeight: 462.5441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)CN(C)C(C)C4=C(NN=C4C)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=O)N(C3=CC=CC=C32)C)CN(C)C(C)C4=C(NN=C4C)C

InChI

InChI=1S/C25H30N6O3/c1-7-34-25(33)19-13-26-31(21-12-23(32)30(6)20-11-9-8-10-18(20)21)22(19)14-29(5)17(4)24-15(2)27-28-16(24)3/h8-13,17H,7,14H2,1-6H3,(H,27,28)