2-[(4-carbamimidoylphenyl)amino]-N-[(4-methylphenyl)sulfonylmethyl]-2-phenyl-ethanamide hydrochloride

Systemtic Name: 2-[(4-carbamimidoylphenyl)amino]-N-[(4-methylphenyl)sulfonylmethyl]-2-phenyl-ethanamide hydrochloride Openeye Name: 2-(4-carbamimidoylanilino)-2-phenyl-N-(p-tolylsulfonylmethyl)acetamide hydrochloride CAS Name: 2-(4-carbamimidoylanilino)-N-[(4-methylphenyl)sulfonylmethyl]-2-phenylacetamide hydrochloride IUPAC Name: 2-(4-carbamimidoylanilino)-N-[(4-methylphenyl)sulfonylmethyl]-2-phenylacetamide hydrochloride Traditional Name: 2-(4-amidinoanilino)-2-phenyl-N-(tosylmethyl)acetamide hydrochloride Formula: C23H25ClN4O3S MolecularWeight: 472.9876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)C(C2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CNC(=O)C(C2=CC=CC=C2)NC3=CC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C23H24N4O3S.ClH/c1-16-7-13-20(14-8-16)31(29,30)15-26-23(28)21(17-5-3-2-4-6-17)27-19-11-9-18(10-12-19)22(24)25;/h2-14,21,27H,15H2,1H3,(H3,24,25)(H,26,28);1H