N-[3-[4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinolin-6-yl]phenyl]ethanamide

Systemtic Name: N-[3-[4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinolin-6-yl]phenyl]ethanamide Openeye Name: N-[3-[4-[4-(4-methylpiperazin-1-yl)anilino]-6-quinolyl]phenyl]acetamide CAS Name: N-[3-[4-[4-(4-methyl-1-piperazinyl)anilino]-6-quinolinyl]phenyl]acetamide IUPAC Name: N-[3-[4-[4-(4-methylpiperazin-1-yl)anilino]quinolin-6-yl]phenyl]acetamide Traditional Name: N-[3-[4-[4-(4-methylpiperazino)anilino]-6-quinolyl]phenyl]acetamide Formula: C28H29N5O MolecularWeight: 451.56276

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=CC3=C(C=CN=C3C=C2)NC4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=CC3=C(C=CN=C3C=C2)NC4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C28H29N5O/c1-20(34)30-24-5-3-4-21(18-24)22-6-11-27-26(19-22)28(12-13-29-27)31-23-7-9-25(10-8-23)33-16-14-32(2)15-17-33/h3-13,18-19H,14-17H2,1-2H3,(H,29,31)(H,30,34)