4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-phenylmethoxy-phenyl]-N1-(2-methylpropyl)benzene-1,3-dicarboxamide

Systemtic Name: 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-phenylmethoxy-phenyl]-N1-(2-methylpropyl)benzene-1,3-dicarboxamide Openeye Name: 4-[4-benzyloxy-2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-N1-isobutyl-benzene-1,3-dicarboxamide CAS Name: 4-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-phenylmethoxyphenyl]-N1-(2-methylpropyl)benzene-1,3-dicarboxamide IUPAC Name: 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-phenylmethoxyphenyl]-1-N-(2-methylpropyl)benzene-1,3-dicarboxamide Traditional Name: 4-[2-[(4-amidinophenyl)carbamoyl]-4-benzoxy-phenyl]-N-isobutyl-isophthalamide Formula: C33H33N5O4 MolecularWeight: 563.64622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)N

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OCC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)N

InChI

InChI=1S/C33H33N5O4/c1-20(2)18-37-32(40)23-10-14-26(28(16-23)31(36)39)27-15-13-25(42-19-21-6-4-3-5-7-21)17-29(27)33(41)38-24-11-8-22(9-12-24)30(34)35/h3-17,20H,18-19H2,1-2H3,(H3,34,35)(H2,36,39)(H,37,40)(H,38,41)