3-carbamimidoyl-N-[2-[(4-ethylphenyl)methylamino]-2-oxidanylidene-ethyl]-N-phenyl-benzamide

Systemtic Name: 3-carbamimidoyl-N-[2-[(4-ethylphenyl)methylamino]-2-oxidanylidene-ethyl]-N-phenyl-benzamide Openeye Name: 3-carbamimidoyl-N-[2-[(4-ethylphenyl)methylamino]-2-oxo-ethyl]-N-phenyl-benzamide CAS Name: 3-carbamimidoyl-N-[2-[(4-ethylphenyl)methylamino]-2-oxoethyl]-N-phenylbenzamide IUPAC Name: 3-carbamimidoyl-N-[2-[(4-ethylphenyl)methylamino]-2-oxoethyl]-N-phenylbenzamide Traditional Name: 3-amidino-N-[2-[(4-ethylbenzyl)amino]-2-keto-ethyl]-N-phenyl-benzamide Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CNC(=O)CN(C2=CC=CC=C2)C(=O)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CCC1=CC=C(C=C1)CNC(=O)CN(C2=CC=CC=C2)C(=O)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C25H26N4O2/c1-2-18-11-13-19(14-12-18)16-28-23(30)17-29(22-9-4-3-5-10-22)25(31)21-8-6-7-20(15-21)24(26)27/h3-15H,2,16-17H2,1H3,(H3,26,27)(H,28,30)