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

Systemtic Name: 4-[2-[[4-chloranyl-3-[(4-methylpiperazin-1-yl)methyl]phenyl]amino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[2-[4-chloro-3-[(4-methylpiperazin-1-yl)methyl]anilino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[2-[4-chloro-3-[(4-methyl-1-piperazinyl)methyl]anilino]-1-methyl-5-benzimidazolyl]oxy]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[2-[4-chloro-3-[(4-methylpiperazin-1-yl)methyl]anilino]-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide Traditional Name: 4-[2-[4-chloro-3-[(4-methylpiperazino)methyl]anilino]-1-methyl-benzimidazol-5-yl]oxy-N-methyl-picolinamide Formula: C27H30ClN7O2 MolecularWeight: 520.0258

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC(=C(C=C4)Cl)CN5CCN(CC5)C)C

Isomeric SMILES

CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N(C(=N3)NC4=CC(=C(C=C4)Cl)CN5CCN(CC5)C)C

InChI

InChI=1S/C27H30ClN7O2/c1-29-26(36)24-16-21(8-9-30-24)37-20-5-7-25-23(15-20)32-27(34(25)3)31-19-4-6-22(28)18(14-19)17-35-12-10-33(2)11-13-35/h4-9,14-16H,10-13,17H2,1-3H3,(H,29,36)(H,31,32)