N-[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butanamide

Systemtic Name: N-[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]-4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butanamide Openeye Name: N-[2-(3,5-dimethyl-1-piperidyl)-4-methyl-6-quinolyl]-4-oxo-4-(4-phenylpiperazin-1-yl)butanamide CAS Name: N-[2-(3,5-dimethyl-1-piperidinyl)-4-methyl-6-quinolinyl]-4-oxo-4-(4-phenyl-1-piperazinyl)butanamide IUPAC Name: N-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-4-oxo-4-(4-phenylpiperazin-1-yl)butanamide Traditional Name: N-[2-(3,5-dimethylpiperidino)-4-methyl-6-quinolyl]-4-keto-4-(4-phenylpiperazino)butyramide Formula: C31H39N5O2 MolecularWeight: 513.67366

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)N4CCN(CC4)C5=CC=CC=C5)C(=C2)C)C

Isomeric SMILES

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)N4CCN(CC4)C5=CC=CC=C5)C(=C2)C)C

InChI

InChI=1S/C31H39N5O2/c1-22-17-23(2)21-36(20-22)29-18-24(3)27-19-25(9-10-28(27)33-29)32-30(37)11-12-31(38)35-15-13-34(14-16-35)26-7-5-4-6-8-26/h4-10,18-19,22-23H,11-17,20-21H2,1-3H3,(H,32,37)