N-[4-[1-[2-[(4-carbamimidoylphenyl)carbamoylamino]ethanoylamino]ethyl]phenyl]-3-phenoxy-benzamide

Systemtic Name: N-[4-[1-[2-[(4-carbamimidoylphenyl)carbamoylamino]ethanoylamino]ethyl]phenyl]-3-phenoxy-benzamide Openeye Name: N-[4-[1-[[2-[(4-carbamimidoylphenyl)carbamoylamino]acetyl]amino]ethyl]phenyl]-3-phenoxy-benzamide CAS Name: N-[4-[1-[[2-[[(4-carbamimidoylanilino)-oxomethyl]amino]-1-oxoethyl]amino]ethyl]phenyl]-3-phenoxybenzamide IUPAC Name: N-[4-[1-[[2-[(4-carbamimidoylphenyl)carbamoylamino]acetyl]amino]ethyl]phenyl]-3-phenoxybenzamide Traditional Name: N-[4-[1-[[2-[(4-amidinophenyl)carbamoylamino]acetyl]amino]ethyl]phenyl]-3-phenoxy-benzamide Formula: C31H30N6O4 MolecularWeight: 550.6077

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)CNC(=O)NC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)OC3=CC=CC=C3)NC(=O)CNC(=O)NC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C31H30N6O4/c1-20(35-28(38)19-34-31(40)37-25-16-12-22(13-17-25)29(32)33)21-10-14-24(15-11-21)36-30(39)23-6-5-9-27(18-23)41-26-7-3-2-4-8-26/h2-18,20H,19H2,1H3,(H3,32,33)(H,35,38)(H,36,39)(H2,34,37,40)