(2S)-2-azanyl-5-[bis(azanyl)methylideneamino]-N-(2,2-diphenylethanoyl)-N-phenethyl-pentanamide

Systemtic Name: (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]-N-(2,2-diphenylethanoyl)-N-phenethyl-pentanamide Openeye Name: (2S)-2-amino-N-(2,2-diphenylacetyl)-5-guanidino-N-phenethyl-pentanamide CAS Name: (2S)-2-amino-5-(diaminomethylideneamino)-N-(1-oxo-2,2-diphenylethyl)-N-phenethylpentanamide IUPAC Name: (2S)-2-amino-5-(diaminomethylideneamino)-N-(2,2-diphenylacetyl)-N-phenethylpentanamide Traditional Name: (2S)-2-amino-N-(2,2-diphenylacetyl)-5-guanidino-N-phenethyl-valeramide Formula: C28H33N5O2 MolecularWeight: 471.59392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(C(=O)C(CCCN=C(N)N)N)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN(C(=O)[C@H](CCCN=C(N)N)N)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H33N5O2/c29-24(17-10-19-32-28(30)31)26(34)33(20-18-21-11-4-1-5-12-21)27(35)25(22-13-6-2-7-14-22)23-15-8-3-9-16-23/h1-9,11-16,24-25H,10,17-20,29H2,(H4,30,31,32)/t24-/m0/s1