N-[4-methyl-3-[[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbonylamino]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide

Systemtic Name: N-[4-methyl-3-[[5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbonylamino]phenyl]-2-morpholin-4-yl-pyridine-4-carboxamide Openeye Name: N-[4-methyl-3-[[5-(4-methylpiperazin-1-yl)-2-nitro-benzoyl]amino]phenyl]-2-morpholino-pyridine-4-carboxamide CAS Name: N-[4-methyl-3-[[[5-(4-methyl-1-piperazinyl)-2-nitrophenyl]-oxomethyl]amino]phenyl]-2-(4-morpholinyl)-4-pyridinecarboxamide IUPAC Name: N-[4-methyl-3-[[5-(4-methylpiperazin-1-yl)-2-nitrobenzoyl]amino]phenyl]-2-morpholin-4-ylpyridine-4-carboxamide Traditional Name: N-[4-methyl-3-[[5-(4-methylpiperazino)-2-nitro-benzoyl]amino]phenyl]-2-morpholino-isonicotinamide Formula: C29H33N7O5 MolecularWeight: 559.61622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCOCC3)NC(=O)C4=C(C=CC(=C4)N5CCN(CC5)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=NC=C2)N3CCOCC3)NC(=O)C4=C(C=CC(=C4)N5CCN(CC5)C)[N+](=O)[O-]

InChI

InChI=1S/C29H33N7O5/c1-20-3-4-22(31-28(37)21-7-8-30-27(17-21)35-13-15-41-16-14-35)18-25(20)32-29(38)24-19-23(5-6-26(24)36(39)40)34-11-9-33(2)10-12-34/h3-8,17-19H,9-16H2,1-2H3,(H,31,37)(H,32,38)