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

Systemtic Name: 4-[1-[2-[(4-carbamimidoylphenyl)carbamoylamino]ethanoylamino]ethyl]-N-phenyl-benzamide Openeye Name: 4-[1-[[2-[(4-carbamimidoylphenyl)carbamoylamino]acetyl]amino]ethyl]-N-phenyl-benzamide CAS Name: 4-[1-[[2-[[(4-carbamimidoylanilino)-oxomethyl]amino]-1-oxoethyl]amino]ethyl]-N-phenylbenzamide IUPAC Name: 4-[1-[[2-[(4-carbamimidoylphenyl)carbamoylamino]acetyl]amino]ethyl]-N-phenylbenzamide Traditional Name: 4-[1-[[2-[(4-amidinophenyl)carbamoylamino]acetyl]amino]ethyl]-N-phenyl-benzamide Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2)NC(=O)CNC(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2)NC(=O)CNC(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H26N6O3/c1-16(17-7-9-19(10-8-17)24(33)30-20-5-3-2-4-6-20)29-22(32)15-28-25(34)31-21-13-11-18(12-14-21)23(26)27/h2-14,16H,15H2,1H3,(H3,26,27)(H,29,32)(H,30,33)(H2,28,31,34)