4-[7-chloranyl-2-[(4-methylphenyl)carbamoylamino]quinolin-4-yl]-N-(4-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[7-chloranyl-2-[(4-methylphenyl)carbamoylamino]quinolin-4-yl]-N-(4-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[7-chloro-2-(p-tolylcarbamoylamino)-4-quinolyl]-N-(p-tolyl)piperazine-1-carboxamide CAS Name: 4-[7-chloro-2-[[(4-methylanilino)-oxomethyl]amino]-4-quinolinyl]-N-(4-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[7-chloro-2-[(4-methylphenyl)carbamoylamino]quinolin-4-yl]-N-(4-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-[7-chloro-2-(p-tolylcarbamoylamino)-4-quinolyl]-N-(p-tolyl)piperazine-1-carboxamide Formula: C29H29ClN6O2 MolecularWeight: 529.03256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=NC3=C(C=CC(=C3)Cl)C(=C2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=NC3=C(C=CC(=C3)Cl)C(=C2)N4CCN(CC4)C(=O)NC5=CC=C(C=C5)C

InChI

InChI=1S/C29H29ClN6O2/c1-19-3-8-22(9-4-19)31-28(37)34-27-18-26(24-12-7-21(30)17-25(24)33-27)35-13-15-36(16-14-35)29(38)32-23-10-5-20(2)6-11-23/h3-12,17-18H,13-16H2,1-2H3,(H,32,38)(H2,31,33,34,37)