4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-3-carboxamide

Systemtic Name: 4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-3-carboxamide Openeye Name: 4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-3-carboxamide CAS Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-[3-(4-methyl-1-piperazinyl)propyl]-3-quinolinecarboxamide IUPAC Name: 4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-3-carboxamide Traditional Name: 4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-N-[3-(4-methylpiperazino)propyl]quinoline-3-carboxamide Formula: C27H31ClN6O2 MolecularWeight: 507.02704

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC(=O)C2=CN=C3C=CC(=CC3=C2NCC4=CC(=C(C=C4)OC)Cl)C#N

Isomeric SMILES

CN1CCN(CC1)CCCNC(=O)C2=CN=C3C=CC(=CC3=C2NCC4=CC(=C(C=C4)OC)Cl)C#N

InChI

InChI=1S/C27H31ClN6O2/c1-33-10-12-34(13-11-33)9-3-8-30-27(35)22-18-31-24-6-4-19(16-29)14-21(24)26(22)32-17-20-5-7-25(36-2)23(28)15-20/h4-7,14-15,18H,3,8-13,17H2,1-2H3,(H,30,35)(H,31,32)