(phenylmethyl) 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-methylsulfinylethylcarbamoyl)benzoate

Systemtic Name: (phenylmethyl) 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-methylsulfinylethylcarbamoyl)benzoate Openeye Name: benzyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-methylsulfinylethylcarbamoyl)benzoate CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-[(2-methylsulfinylethylamino)-oxomethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-methylsulfinylethylcarbamoyl)benzoate Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-(2-methylsulfinylethylcarbamoyl)benzoic acid benzyl ester Formula: C32H30N4O5S MolecularWeight: 582.6694

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CCNC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CS(=O)CCNC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H30N4O5S/c1-42(40)18-17-35-30(37)23-13-16-26(28(19-23)32(39)41-20-21-7-3-2-4-8-21)25-9-5-6-10-27(25)31(38)36-24-14-11-22(12-15-24)29(33)34/h2-16,19H,17-18,20H2,1H3,(H3,33,34)(H,35,37)(H,36,38)