N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]quinoline-2-carboxamide

Systemtic Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]quinoline-2-carboxamide Openeye Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]quinoline-2-carboxamide CAS Name: N-[3-[4-methyl-1-(4-phenyl-1-piperazinyl)cyclohexyl]phenyl]-2-quinolinecarboxamide IUPAC Name: N-[3-[4-methyl-1-(4-phenylpiperazin-1-yl)cyclohexyl]phenyl]quinoline-2-carboxamide Traditional Name: N-[3-[4-methyl-1-(4-phenylpiperazino)cyclohexyl]phenyl]quinaldamide Formula: C33H36N4O MolecularWeight: 504.66514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C3=NC4=CC=CC=C4C=C3)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

CC1CCC(CC1)(C2=CC(=CC=C2)NC(=O)C3=NC4=CC=CC=C4C=C3)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C33H36N4O/c1-25-16-18-33(19-17-25,37-22-20-36(21-23-37)29-11-3-2-4-12-29)27-9-7-10-28(24-27)34-32(38)31-15-14-26-8-5-6-13-30(26)35-31/h2-15,24-25H,16-23H2,1H3,(H,34,38)