(2S)-5-[bis(azanyl)methylideneamino]-N-oxidanyl-2-[(phenylmethyl)carbamoylamino]pentanamide

Systemtic Name: (2S)-5-[bis(azanyl)methylideneamino]-N-oxidanyl-2-[(phenylmethyl)carbamoylamino]pentanamide Openeye Name: 1-benzyl-3-[(1S)-4-guanidino-1-(hydroxycarbamoyl)butyl]urea CAS Name: (2S)-5-(diaminomethylideneamino)-N-hydroxy-2-[[oxo-[(phenylmethyl)amino]methyl]amino]pentanamide IUPAC Name: (2S)-2-(benzylcarbamoylamino)-5-(diaminomethylideneamino)-N-hydroxypentanamide Traditional Name: 1-benzyl-3-[(1S)-4-guanidino-1-(hydroxycarbamoyl)butyl]urea Formula: C14H22N6O3 MolecularWeight: 322.36288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NC(CCCN=C(N)N)C(=O)NO

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)N[C@@H](CCCN=C(N)N)C(=O)NO

InChI

InChI=1S/C14H22N6O3/c15-13(16)17-8-4-7-11(12(21)20-23)19-14(22)18-9-10-5-2-1-3-6-10/h1-3,5-6,11,23H,4,7-9H2,(H,20,21)(H4,15,16,17)(H2,18,19,22)/t11-/m0/s1