(phenylmethyl) 2-[2-[(4-carbamimidoyl-2-methyl-phenyl)carbamoyl]phenyl]-5-(2-methylpropylcarbamoyl)benzoate

Systemtic Name: (phenylmethyl) 2-[2-[(4-carbamimidoyl-2-methyl-phenyl)carbamoyl]phenyl]-5-(2-methylpropylcarbamoyl)benzoate Openeye Name: benzyl 2-[2-[(4-carbamimidoyl-2-methyl-phenyl)carbamoyl]phenyl]-5-(isobutylcarbamoyl)benzoate CAS Name: 2-[2-[(4-carbamimidoyl-2-methylanilino)-oxomethyl]phenyl]-5-[(2-methylpropylamino)-oxomethyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-[(4-carbamimidoyl-2-methylphenyl)carbamoyl]phenyl]-5-(2-methylpropylcarbamoyl)benzoate Traditional Name: 2-[2-[(4-amidino-2-methyl-phenyl)carbamoyl]phenyl]-5-(isobutylcarbamoyl)benzoic acid benzyl ester Formula: C34H34N4O4 MolecularWeight: 562.65816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=N)N)NC(=O)C2=CC=CC=C2C3=C(C=C(C=C3)C(=O)NCC(C)C)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=N)N)NC(=O)C2=CC=CC=C2C3=C(C=C(C=C3)C(=O)NCC(C)C)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C34H34N4O4/c1-21(2)19-37-32(39)25-13-15-27(29(18-25)34(41)42-20-23-9-5-4-6-10-23)26-11-7-8-12-28(26)33(40)38-30-16-14-24(31(35)36)17-22(30)3/h4-18,21H,19-20H2,1-3H3,(H3,35,36)(H,37,39)(H,38,40)