methyl 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylate

Systemtic Name: methyl 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylate Openeye Name: methyl 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-vinyl-phenyl]-6-(isobutylcarbamoyl)pyridine-2-carboxylate CAS Name: 3-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-ethenylphenyl]-6-[(2-methylpropylamino)-oxomethyl]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenylphenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylate Traditional Name: 3-[2-[(4-amidinophenyl)carbamoyl]-4-vinyl-phenyl]-6-(isobutylcarbamoyl)picolinic acid methyl ester Formula: C28H29N5O4 MolecularWeight: 499.56096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=NC(=C(C=C1)C2=C(C=C(C=C2)C=C)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OC

Isomeric SMILES

CC(C)CNC(=O)C1=NC(=C(C=C1)C2=C(C=C(C=C2)C=C)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)OC

InChI

InChI=1S/C28H29N5O4/c1-5-17-6-11-20(22(14-17)26(34)32-19-9-7-18(8-10-19)25(29)30)21-12-13-23(27(35)31-15-16(2)3)33-24(21)28(36)37-4/h5-14,16H,1,15H2,2-4H3,(H3,29,30)(H,31,35)(H,32,34)