1-(3-chloranyl-4-pyridin-4-yl-phenyl)-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea

Systemtic Name: 1-(3-chloranyl-4-pyridin-4-yl-phenyl)-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea Openeye Name: 1-[3-chloro-4-(4-pyridyl)phenyl]-3-[4-(4-methylpiperazin-1-yl)-6-quinolyl]urea CAS Name: 1-(3-chloro-4-pyridin-4-ylphenyl)-3-[4-(4-methyl-1-piperazinyl)-6-quinolinyl]urea IUPAC Name: 1-(3-chloro-4-pyridin-4-ylphenyl)-3-[4-(4-methylpiperazin-1-yl)quinolin-6-yl]urea Traditional Name: 1-[3-chloro-4-(4-pyridyl)phenyl]-3-[4-(4-methylpiperazino)-6-quinolyl]urea Formula: C26H25ClN6O MolecularWeight: 472.9693

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)NC(=O)NC4=CC(=C(C=C4)C5=CC=NC=C5)Cl

Isomeric SMILES

CN1CCN(CC1)C2=C3C=C(C=CC3=NC=C2)NC(=O)NC4=CC(=C(C=C4)C5=CC=NC=C5)Cl

InChI

InChI=1S/C26H25ClN6O/c1-32-12-14-33(15-13-32)25-8-11-29-24-5-3-19(16-22(24)25)30-26(34)31-20-2-4-21(23(27)17-20)18-6-9-28-10-7-18/h2-11,16-17H,12-15H2,1H3,(H2,30,31,34)