4-[1-methyl-2-[(4-methylphenyl)amino]benzimidazol-5-yl]oxy-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-2-carboxamide

Systemtic Name: 4-[1-methyl-2-[(4-methylphenyl)amino]benzimidazol-5-yl]oxy-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-2-carboxamide Openeye Name: 4-[1-methyl-2-(4-methylanilino)benzimidazol-5-yl]oxy-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-2-carboxamide CAS Name: 4-[[1-methyl-2-(4-methylanilino)-5-benzimidazolyl]oxy]-N-[3-(4-methyl-1-piperazinyl)propyl]-2-pyridinecarboxamide IUPAC Name: 4-[1-methyl-2-(4-methylanilino)benzimidazol-5-yl]oxy-N-[3-(4-methylpiperazin-1-yl)propyl]pyridine-2-carboxamide Traditional Name: N-[3-(4-methylpiperazino)propyl]-4-[1-methyl-2-(p-toluidino)benzimidazol-5-yl]oxy-picolinamide Formula: C29H35N7O2 MolecularWeight: 513.6339

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC3=C(N2C)C=CC(=C3)OC4=CC(=NC=C4)C(=O)NCCCN5CCN(CC5)C

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC3=C(N2C)C=CC(=C3)OC4=CC(=NC=C4)C(=O)NCCCN5CCN(CC5)C

InChI

InChI=1S/C29H35N7O2/c1-21-5-7-22(8-6-21)32-29-33-25-19-23(9-10-27(25)35(29)3)38-24-11-13-30-26(20-24)28(37)31-12-4-14-36-17-15-34(2)16-18-36/h5-11,13,19-20H,4,12,14-18H2,1-3H3,(H,31,37)(H,32,33)