8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-4-(4-methylpiperazin-1-yl)quinoline-3-carboxamide

Systemtic Name: 8-[[2,6-bis(chloranyl)phenyl]carbonylamino]-4-(4-methylpiperazin-1-yl)quinoline-3-carboxamide Openeye Name: 8-[(2,6-dichlorobenzoyl)amino]-4-(4-methylpiperazin-1-yl)quinoline-3-carboxamide CAS Name: 8-[[(2,6-dichlorophenyl)-oxomethyl]amino]-4-(4-methyl-1-piperazinyl)-3-quinolinecarboxamide IUPAC Name: 8-[(2,6-dichlorobenzoyl)amino]-4-(4-methylpiperazin-1-yl)quinoline-3-carboxamide Traditional Name: 8-[(2,6-dichlorobenzoyl)amino]-4-(4-methylpiperazino)quinoline-3-carboxamide Formula: C22H21Cl2N5O2 MolecularWeight: 458.34044

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=CC=C(C3=NC=C2C(=O)N)NC(=O)C4=C(C=CC=C4Cl)Cl

Isomeric SMILES

CN1CCN(CC1)C2=C3C=CC=C(C3=NC=C2C(=O)N)NC(=O)C4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C22H21Cl2N5O2/c1-28-8-10-29(11-9-28)20-13-4-2-7-17(19(13)26-12-14(20)21(25)30)27-22(31)18-15(23)5-3-6-16(18)24/h2-7,12H,8-11H2,1H3,(H2,25,30)(H,27,31)