N-(1-azanyl-1-oxidanylidene-3-pyridin-3-yl-propan-2-yl)-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-(1-azanyl-1-oxidanylidene-3-pyridin-3-yl-propan-2-yl)-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-amino-2-oxo-1-(3-pyridylmethyl)ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-amino-1-oxo-3-(3-pyridinyl)propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-(1-amino-1-oxo-3-pyridin-3-ylpropan-2-yl)-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-amino-2-keto-1-(3-pyridylmethyl)ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N6O2/c22-19(28)18(10-13-2-1-7-24-12-13)27-21(29)15-3-4-16-17(11-15)26-20(25-16)14-5-8-23-9-6-14/h1-9,11-12,18H,10H2,(H2,22,28)(H,25,26)(H,27,29)