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

Systemtic Name: (2S)-2-azanyl-5-[bis(azanyl)methylideneamino]-N-(2,2-diphenylethanoyl)-2-methyl-pentanamide Openeye Name: (2S)-2-amino-N-(2,2-diphenylacetyl)-5-guanidino-2-methyl-pentanamide CAS Name: (2S)-2-amino-5-(diaminomethylideneamino)-2-methyl-N-(1-oxo-2,2-diphenylethyl)pentanamide IUPAC Name: (2S)-2-amino-5-(diaminomethylideneamino)-N-(2,2-diphenylacetyl)-2-methylpentanamide Traditional Name: (2S)-2-amino-N-(2,2-diphenylacetyl)-5-guanidino-2-methyl-valeramide Formula: C21H27N5O2 MolecularWeight: 381.47138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@](CCCN=C(N)N)(C(=O)NC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2)N

InChI

InChI=1S/C21H27N5O2/c1-21(24,13-8-14-25-20(22)23)19(28)26-18(27)17(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-7,9-12,17H,8,13-14,24H2,1H3,(H4,22,23,25)(H,26,27,28)/t21-/m0/s1