[1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(2,5-dimethoxyphenyl)carbamoyl]propyl 2-(3-pyridyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(3-pyridinyl)-3H-benzimidazole-5-carboxylic acid [1-(2,5-dimethoxyanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,5-dimethoxyanilino)-1-oxobutan-2-yl] 2-pyridin-3-yl-3H-benzimidazole-5-carboxylate Traditional Name: 2-(3-pyridyl)-3H-benzimidazole-5-carboxylic acid 1-[(2,5-dimethoxyphenyl)carbamoyl]propyl ester Formula: C25H24N4O5 MolecularWeight: 460.48186

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=CC(=C1)OC)OC)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CN=CC=C4

Isomeric SMILES

CCC(C(=O)NC1=C(C=CC(=C1)OC)OC)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CN=CC=C4

InChI

InChI=1S/C25H24N4O5/c1-4-21(24(30)29-20-13-17(32-2)8-10-22(20)33-3)34-25(31)15-7-9-18-19(12-15)28-23(27-18)16-6-5-11-26-14-16/h5-14,21H,4H2,1-3H3,(H,27,28)(H,29,30)