[1-oxidanylidene-1-(pyridin-3-ylamino)propan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(pyridin-3-ylamino)propan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-pyridylamino)ethyl] 2-phenyl-3H-benzimidazole-5-carboxylate CAS Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [1-oxo-1-(3-pyridinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(pyridin-3-ylamino)propan-2-yl] 2-phenyl-3H-benzimidazole-5-carboxylate Traditional Name: 2-phenyl-3H-benzimidazole-5-carboxylic acid [2-keto-1-methyl-2-(3-pyridylamino)ethyl] ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O3/c1-14(21(27)24-17-8-5-11-23-13-17)29-22(28)16-9-10-18-19(12-16)26-20(25-18)15-6-3-2-4-7-15/h2-14H,1H3,(H,24,27)(H,25,26)