4-(N-cyclopropyl-C-methyl-carbonimidoyl)-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one

Systemtic Name: 4-(N-cyclopropyl-C-methyl-carbonimidoyl)-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one Openeye Name: 4-(N-cyclopropyl-C-methyl-carbonimidoyl)-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one CAS Name: 4-(1-cyclopropyliminoethyl)-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one IUPAC Name: 4-(N-cyclopropyl-C-methylcarbonimidoyl)-2-(4-methoxyphenyl)-5-phenyl-4H-pyrazol-3-one Traditional Name: 4-(N-cyclopropyl-C-methyl-carbonimidoyl)-2-(4-methoxyphenyl)-5-phenyl-2-pyrazolin-3-one Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1CC1)C2C(=NN(C2=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC(=NC1CC1)C2C(=NN(C2=O)C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2/c1-14(22-16-8-9-16)19-20(15-6-4-3-5-7-15)23-24(21(19)25)17-10-12-18(26-2)13-11-17/h3-7,10-13,16,19H,8-9H2,1-2H3