(phenylmethyl) N-[(N'-butyl-N-phenylmethoxycarbonyl-carbamimidoyl)carbamoyl]carbamate

Systemtic Name: (phenylmethyl) N-[(N'-butyl-N-phenylmethoxycarbonyl-carbamimidoyl)carbamoyl]carbamate Openeye Name: benzyl N-[(N-benzyloxycarbonyl-N'-butyl-carbamimidoyl)carbamoyl]carbamate CAS Name: N-[butylimino-[[oxo(phenylmethoxycarbonylamino)methyl]amino]methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(N'-butyl-N-phenylmethoxycarbonylcarbamimidoyl)carbamoyl]carbamate Traditional Name: N-[(N'-butyl-N-carbobenzoxy-amidino)carbamoyl]carbamic acid benzyl ester Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C(NC(=O)NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCN=C(NC(=O)NC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N4O5/c1-2-3-14-23-19(25-21(28)30-15-17-10-6-4-7-11-17)24-20(27)26-22(29)31-16-18-12-8-5-9-13-18/h4-13H,2-3,14-16H2,1H3,(H3,23,24,25,26,27,28,29)