4-carbamimidoyl-N-[1-oxidanylidene-3-(3-phenoxyphenyl)-1-phenylazanyl-propan-2-yl]benzamide

Systemtic Name: 4-carbamimidoyl-N-[1-oxidanylidene-3-(3-phenoxyphenyl)-1-phenylazanyl-propan-2-yl]benzamide Openeye Name: N-[2-anilino-2-oxo-1-[(3-phenoxyphenyl)methyl]ethyl]-4-carbamimidoyl-benzamide CAS Name: N-[1-anilino-1-oxo-3-(3-phenoxyphenyl)propan-2-yl]-4-carbamimidoylbenzamide IUPAC Name: N-[1-anilino-1-oxo-3-(3-phenoxyphenyl)propan-2-yl]-4-carbamimidoylbenzamide Traditional Name: 4-amidino-N-[2-anilino-2-keto-1-(3-phenoxybenzyl)ethyl]benzamide Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(CC2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(CC2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C29H26N4O3/c30-27(31)21-14-16-22(17-15-21)28(34)33-26(29(35)32-23-9-3-1-4-10-23)19-20-8-7-13-25(18-20)36-24-11-5-2-6-12-24/h1-18,26H,19H2,(H3,30,31)(H,32,35)(H,33,34)