1-[3-methyl-4-(6-methylpyridin-2-yl)phenyl]-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea

Systemtic Name: 1-[3-methyl-4-(6-methylpyridin-2-yl)phenyl]-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea Openeye Name: 1-[3-methyl-4-(6-methyl-2-pyridyl)phenyl]-3-[4-(4-methylpiperazin-1-yl)-6-quinolyl]urea CAS Name: 1-[3-methyl-4-(6-methyl-2-pyridinyl)phenyl]-3-[4-(4-methyl-1-piperazinyl)-6-quinolinyl]urea IUPAC Name: 1-[3-methyl-4-(6-methylpyridin-2-yl)phenyl]-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea Traditional Name: 1-[3-methyl-4-(6-methyl-2-pyridyl)phenyl]-3-[4-(4-methylpiperazino)-6-quinolyl]urea Formula: C28H30N6O MolecularWeight: 466.5774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C2=C(C=C(C=C2)NC(=O)NC3=CC4=C(C=CN=C4C=C3)N5CCN(CC5)C)C

Isomeric SMILES

CC1=CC=CC(=N1)C2=C(C=C(C=C2)NC(=O)NC3=CC4=C(C=CN=C4C=C3)N5CCN(CC5)C)C

InChI

InChI=1S/C28H30N6O/c1-19-17-21(7-9-23(19)26-6-4-5-20(2)30-26)31-28(35)32-22-8-10-25-24(18-22)27(11-12-29-25)34-15-13-33(3)14-16-34/h4-12,17-18H,13-16H2,1-3H3,(H2,31,32,35)