2-(3-acetamidophenyl)-2-[(4-carbamimidoylphenyl)amino]-N-(phenylmethyl)ethanamide; ethanoic acid

Systemtic Name: 2-(3-acetamidophenyl)-2-[(4-carbamimidoylphenyl)amino]-N-(phenylmethyl)ethanamide; ethanoic acid Openeye Name: 2-(3-acetamidophenyl)-N-benzyl-2-(4-carbamimidoylanilino)acetamide; acetic acid CAS Name: 2-(3-acetamidophenyl)-2-(4-carbamimidoylanilino)-N-(phenylmethyl)acetamide; acetic acid IUPAC Name: 2-(3-acetamidophenyl)-N-benzyl-2-(4-carbamimidoylanilino)acetamide; acetic acid Traditional Name: 2-(3-acetamidophenyl)-2-(4-amidinoanilino)-N-benzyl-acetamide; acetic acid Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(C(=O)NCC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N.CC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(C(=O)NCC2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N.CC(=O)O

InChI

InChI=1S/C24H25N5O2.C2H4O2/c1-16(30)28-21-9-5-8-19(14-21)22(24(31)27-15-17-6-3-2-4-7-17)29-20-12-10-18(11-13-20)23(25)26;1-2(3)4/h2-14,22,29H,15H2,1H3,(H3,25,26)(H,27,31)(H,28,30);1H3,(H,3,4)