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

Systemtic Name: N-[3-(4-aminophenyl)-1-azanyl-1-oxidanylidene-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-amino-1-[(4-aminophenyl)methyl]-2-oxo-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-amino-3-(4-aminophenyl)-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-amino-3-(4-aminophenyl)-1-oxopropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-amino-1-(4-aminobenzyl)-2-keto-ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C22H20N6O2 MolecularWeight: 400.4332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)N)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4)N

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)N)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4)N

InChI

InChI=1S/C22H20N6O2/c23-16-4-1-13(2-5-16)11-19(20(24)29)28-22(30)15-3-6-17-18(12-15)27-21(26-17)14-7-9-25-10-8-14/h1-10,12,19H,11,23H2,(H2,24,29)(H,26,27)(H,28,30)