4-[3-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-2-yl]-N1-(2-methylpropyl)-N3-phenylmethoxy-benzene-1,3-dicarboxamide

Systemtic Name: 4-[3-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-2-yl]-N1-(2-methylpropyl)-N3-phenylmethoxy-benzene-1,3-dicarboxamide Openeye Name: N3-benzyloxy-4-[3-[(4-carbamimidoylphenyl)carbamoyl]-2-naphthyl]-N1-isobutyl-benzene-1,3-dicarboxamide CAS Name: 4-[3-[(4-carbamimidoylanilino)-oxomethyl]-2-naphthalenyl]-N1-(2-methylpropyl)-N3-phenylmethoxybenzene-1,3-dicarboxamide IUPAC Name: 4-[3-[(4-carbamimidoylphenyl)carbamoyl]naphthalen-2-yl]-1-N-(2-methylpropyl)-3-N-phenylmethoxybenzene-1,3-dicarboxamide Traditional Name: 4-[3-[(4-amidinophenyl)carbamoyl]-2-naphthyl]-N'-benzoxy-N-isobutyl-isophthalamide Formula: C37H35N5O4 MolecularWeight: 613.7049

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=CC3=CC=CC=C3C=C2C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)NOCC5=CC=CC=C5

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=CC3=CC=CC=C3C=C2C(=O)NC4=CC=C(C=C4)C(=N)N)C(=O)NOCC5=CC=CC=C5

InChI

InChI=1S/C37H35N5O4/c1-23(2)21-40-35(43)28-14-17-30(32(20-28)37(45)42-46-22-24-8-4-3-5-9-24)31-18-26-10-6-7-11-27(26)19-33(31)36(44)41-29-15-12-25(13-16-29)34(38)39/h3-20,23H,21-22H2,1-2H3,(H3,38,39)(H,40,43)(H,41,44)(H,42,45)