N-[4-[6-methyl-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-quinolin-2-yl]phenyl]ethanamide

Systemtic Name: N-[4-[6-methyl-4-[4-(phenylmethyl)piperazin-1-yl]carbonyl-quinolin-2-yl]phenyl]ethanamide Openeye Name: N-[4-[4-(4-benzylpiperazine-1-carbonyl)-6-methyl-2-quinolyl]phenyl]acetamide CAS Name: N-[4-[6-methyl-4-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-2-quinolinyl]phenyl]acetamide IUPAC Name: N-[4-[4-(4-benzylpiperazine-1-carbonyl)-6-methylquinolin-2-yl]phenyl]acetamide Traditional Name: N-[4-[4-(4-benzylpiperazine-1-carbonyl)-6-methyl-2-quinolyl]phenyl]acetamide Formula: C30H30N4O2 MolecularWeight: 478.5848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)NC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)NC(=O)C

InChI

InChI=1S/C30H30N4O2/c1-21-8-13-28-26(18-21)27(19-29(32-28)24-9-11-25(12-10-24)31-22(2)35)30(36)34-16-14-33(15-17-34)20-23-6-4-3-5-7-23/h3-13,18-19H,14-17,20H2,1-2H3,(H,31,35)