4-[2-[[3-(3-chloranylpyridin-4-yl)-4-methyl-phenyl]amino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide

Systemtic Name: 4-[2-[[3-(3-chloranylpyridin-4-yl)-4-methyl-phenyl]amino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide Openeye Name: 4-[2-[3-(3-chloro-4-pyridyl)-4-methyl-anilino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-methyl-pyridine-2-carboxamide CAS Name: 4-[[2-[3-(3-chloro-4-pyridinyl)-4-methylanilino]-6-methoxy-1-methyl-5-benzimidazolyl]oxy]-N-methyl-2-pyridinecarboxamide IUPAC Name: 4-[2-[3-(3-chloropyridin-4-yl)-4-methylanilino]-6-methoxy-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide Traditional Name: 4-[2-[3-(3-chloro-4-pyridyl)-4-methyl-anilino]-6-methoxy-1-methyl-benzimidazol-5-yl]oxy-N-methyl-picolinamide Formula: C28H25ClN6O3 MolecularWeight: 528.9895

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC3=CC(=C(C=C3N2C)OC)OC4=CC(=NC=C4)C(=O)NC)C5=C(C=NC=C5)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC3=CC(=C(C=C3N2C)OC)OC4=CC(=NC=C4)C(=O)NC)C5=C(C=NC=C5)Cl

InChI

InChI=1S/C28H25ClN6O3/c1-16-5-6-17(11-20(16)19-8-9-31-15-21(19)29)33-28-34-22-13-26(25(37-4)14-24(22)35(28)3)38-18-7-10-32-23(12-18)27(36)30-2/h5-15H,1-4H3,(H,30,36)(H,33,34)