4-(3-cyano-7-ethoxy-6-methoxy-quinolin-4-yl)-N-(4-cyanophenyl)piperazine-1-carboxamide

Systemtic Name: 4-(3-cyano-7-ethoxy-6-methoxy-quinolin-4-yl)-N-(4-cyanophenyl)piperazine-1-carboxamide Openeye Name: 4-(3-cyano-7-ethoxy-6-methoxy-4-quinolyl)-N-(4-cyanophenyl)piperazine-1-carboxamide CAS Name: 4-(3-cyano-7-ethoxy-6-methoxy-4-quinolinyl)-N-(4-cyanophenyl)-1-piperazinecarboxamide IUPAC Name: 4-(3-cyano-7-ethoxy-6-methoxyquinolin-4-yl)-N-(4-cyanophenyl)piperazine-1-carboxamide Traditional Name: 4-(3-cyano-7-ethoxy-6-methoxy-4-quinolyl)-N-(4-cyanophenyl)piperazine-1-carboxamide Formula: C25H24N6O3 MolecularWeight: 456.49646

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)N=CC(=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)C#N)OC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)N=CC(=C2N3CCN(CC3)C(=O)NC4=CC=C(C=C4)C#N)C#N)OC

InChI

InChI=1S/C25H24N6O3/c1-3-34-23-13-21-20(12-22(23)33-2)24(18(15-27)16-28-21)30-8-10-31(11-9-30)25(32)29-19-6-4-17(14-26)5-7-19/h4-7,12-13,16H,3,8-11H2,1-2H3,(H,29,32)