2-methoxy-N-[2-(4-methylpiperazin-1-yl)-1H-benzimidazol-4-yl]-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)benzamide

Systemtic Name: 2-methoxy-N-[2-(4-methylpiperazin-1-yl)-1H-benzimidazol-4-yl]-4-(2,3,4,5-tetrahydro-1-benzazepin-1-ylcarbonyl)benzamide Openeye Name: 2-methoxy-N-[2-(4-methylpiperazin-1-yl)-1H-benzimidazol-4-yl]-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzamide CAS Name: 2-methoxy-N-[2-(4-methyl-1-piperazinyl)-1H-benzimidazol-4-yl]-4-[oxo(2,3,4,5-tetrahydro-1-benzazepin-1-yl)methyl]benzamide IUPAC Name: 2-methoxy-N-[2-(4-methylpiperazin-1-yl)-1H-benzimidazol-4-yl]-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzamide Traditional Name: 2-methoxy-N-[2-(4-methylpiperazino)-1H-benzimidazol-4-yl]-4-(2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl)benzamide Formula: C31H34N6O3 MolecularWeight: 538.64006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC3=C(N2)C=CC=C3NC(=O)C4=C(C=C(C=C4)C(=O)N5CCCCC6=CC=CC=C65)OC

Isomeric SMILES

CN1CCN(CC1)C2=NC3=C(N2)C=CC=C3NC(=O)C4=C(C=C(C=C4)C(=O)N5CCCCC6=CC=CC=C65)OC

InChI

InChI=1S/C31H34N6O3/c1-35-16-18-36(19-17-35)31-33-25-11-7-10-24(28(25)34-31)32-29(38)23-14-13-22(20-27(23)40-2)30(39)37-15-6-5-9-21-8-3-4-12-26(21)37/h3-4,7-8,10-14,20H,5-6,9,15-19H2,1-2H3,(H,32,38)(H,33,34)