N-[[4-[[(4-carbamimidoylphenyl)carbonylamino]methoxymethyl]phenyl]methyl]-4-cyano-benzamide

Systemtic Name: N-[[4-[[(4-carbamimidoylphenyl)carbonylamino]methoxymethyl]phenyl]methyl]-4-cyano-benzamide Openeye Name: N-[[4-[[(4-carbamimidoylbenzoyl)amino]methoxymethyl]phenyl]methyl]-4-cyano-benzamide CAS Name: N-[[4-[[[(4-carbamimidoylphenyl)-oxomethyl]amino]methoxymethyl]phenyl]methyl]-4-cyanobenzamide IUPAC Name: N-[[4-[[(4-carbamimidoylbenzoyl)amino]methoxymethyl]phenyl]methyl]-4-cyanobenzamide Traditional Name: N-[4-[[(4-amidinobenzoyl)amino]methoxymethyl]benzyl]-4-cyano-benzamide Formula: C25H23N5O3 MolecularWeight: 441.48182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)COCNC(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)COCNC(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H23N5O3/c26-13-17-5-7-21(8-6-17)24(31)29-14-18-1-3-19(4-2-18)15-33-16-30-25(32)22-11-9-20(10-12-22)23(27)28/h1-12H,14-16H2,(H3,27,28)(H,29,31)(H,30,32)