4-(3-aminophenyl)-N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxidanyl-1-phenyl-butan-2-yl]benzamide

Systemtic Name: 4-(3-aminophenyl)-N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxidanyl-1-phenyl-butan-2-yl]benzamide Openeye Name: 4-(3-aminophenyl)-N-[1-benzyl-2-[(3-carbamimidoylphenyl)methyl]-3-hydroxy-propyl]benzamide CAS Name: 4-(3-aminophenyl)-N-[3-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-1-phenylbutan-2-yl]benzamide IUPAC Name: 4-(3-aminophenyl)-N-[3-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-1-phenylbutan-2-yl]benzamide Traditional Name: N-[2-(3-amidinobenzyl)-1-benzyl-3-hydroxy-propyl]-4-(3-aminophenyl)benzamide Formula: C31H32N4O2 MolecularWeight: 492.61138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(CC2=CC=CC(=C2)C(=N)N)CO)NC(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(CC2=CC=CC(=C2)C(=N)N)CO)NC(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)N

InChI

InChI=1S/C31H32N4O2/c32-28-11-5-9-25(19-28)23-12-14-24(15-13-23)31(37)35-29(18-21-6-2-1-3-7-21)27(20-36)17-22-8-4-10-26(16-22)30(33)34/h1-16,19,27,29,36H,17-18,20,32H2,(H3,33,34)(H,35,37)