5-[bis(azanyl)methylideneamino]-2-(2,2-diphenylethanoylamino)-N-(phenylmethyl)pentanamide

Systemtic Name: 5-[bis(azanyl)methylideneamino]-2-(2,2-diphenylethanoylamino)-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-2-[(2,2-diphenylacetyl)amino]-5-guanidino-pentanamide CAS Name: 5-(diaminomethylideneamino)-2-[(1-oxo-2,2-diphenylethyl)amino]-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-5-(diaminomethylideneamino)-2-[(2,2-diphenylacetyl)amino]pentanamide Traditional Name: N-benzyl-2-[(2,2-diphenylacetyl)amino]-5-guanidino-valeramide Formula: C27H31N5O2 MolecularWeight: 457.56734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(CCCN=C(N)N)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(CCCN=C(N)N)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H31N5O2/c28-27(29)30-18-10-17-23(25(33)31-19-20-11-4-1-5-12-20)32-26(34)24(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-9,11-16,23-24H,10,17-19H2,(H,31,33)(H,32,34)(H4,28,29,30)