(4S)-2-(4-chlorophenyl)-5-ethoxy-4-(pyridin-3-ylmethyliminomethyl)-4H-pyrazol-3-one

Systemtic Name: (4S)-2-(4-chlorophenyl)-5-ethoxy-4-(pyridin-3-ylmethyliminomethyl)-4H-pyrazol-3-one Openeye Name: (4S)-2-(4-chlorophenyl)-5-ethoxy-4-(3-pyridylmethyliminomethyl)-4H-pyrazol-3-one CAS Name: (4S)-2-(4-chlorophenyl)-5-ethoxy-4-(3-pyridinylmethyliminomethyl)-4H-pyrazol-3-one IUPAC Name: (4S)-2-(4-chlorophenyl)-5-ethoxy-4-(pyridin-3-ylmethyliminomethyl)-4H-pyrazol-3-one Traditional Name: (4S)-2-(4-chlorophenyl)-5-ethoxy-4-(3-pyridylmethyliminomethyl)-2-pyrazolin-3-one Formula: C18H17ClN4O2 MolecularWeight: 356.80618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=O)C1C=NCC2=CN=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=NN(C(=O)[C@H]1C=NCC2=CN=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN4O2/c1-2-25-17-16(12-21-11-13-4-3-9-20-10-13)18(24)23(22-17)15-7-5-14(19)6-8-15/h3-10,12,16H,2,11H2,1H3/t16-/m0/s1