(phenylmethyl) N-[N'-[(4S)-4-azanyl-5-sulfamoyl-pentyl]-N-phenylmethoxycarbonyl-carbamimidoyl]carbamate

Systemtic Name: (phenylmethyl) N-[N'-[(4S)-4-azanyl-5-sulfamoyl-pentyl]-N-phenylmethoxycarbonyl-carbamimidoyl]carbamate Openeye Name: benzyl N-[N'-[(4S)-4-amino-5-sulfamoyl-pentyl]-N-benzyloxycarbonyl-carbamimidoyl]carbamate CAS Name: N-[[(4S)-4-amino-5-sulfamoylpentyl]imino-(phenylmethoxycarbonylamino)methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[N'-[(4S)-4-amino-5-sulfamoylpentyl]-N-phenylmethoxycarbonylcarbamimidoyl]carbamate Traditional Name: N-[N'-[(4S)-4-amino-5-sulfamoyl-pentyl]-N-carbobenzoxy-amidino]carbamic acid benzyl ester Formula: C22H29N5O6S MolecularWeight: 491.56056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(=NCCCC(CS(=O)(=O)N)N)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(=NCCC[C@@H](CS(=O)(=O)N)N)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H29N5O6S/c23-19(16-34(24,30)31)12-7-13-25-20(26-21(28)32-14-17-8-3-1-4-9-17)27-22(29)33-15-18-10-5-2-6-11-18/h1-6,8-11,19H,7,12-16,23H2,(H2,24,30,31)(H2,25,26,27,28,29)/t19-/m0/s1