N-[(3-aminophenyl)methyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)ethanamide

Systemtic Name: N-[(3-aminophenyl)methyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)ethanamide Openeye Name: N-[(3-aminophenyl)methyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)acetamide CAS Name: N-[(3-aminophenyl)methyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)acetamide IUPAC Name: N-[(3-aminophenyl)methyl]-2-(6-carbamimidoyl-1H-benzimidazol-2-yl)acetamide Traditional Name: 2-(6-amidino-1H-benzimidazol-2-yl)-N-(3-aminobenzyl)acetamide Formula: C17H18N6O MolecularWeight: 322.36442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CNC(=O)CC2=NC3=C(N2)C=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)N)CNC(=O)CC2=NC3=C(N2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C17H18N6O/c18-12-3-1-2-10(6-12)9-21-16(24)8-15-22-13-5-4-11(17(19)20)7-14(13)23-15/h1-7H,8-9,18H2,(H3,19,20)(H,21,24)(H,22,23)