2-azanyl-5-[bis(azanyl)methylideneamino]-N-(2,2-diphenylethanoyl)-N-(pyridin-4-ylmethyl)pentanamide

Systemtic Name: 2-azanyl-5-[bis(azanyl)methylideneamino]-N-(2,2-diphenylethanoyl)-N-(pyridin-4-ylmethyl)pentanamide Openeye Name: 2-amino-N-(2,2-diphenylacetyl)-5-guanidino-N-(4-pyridylmethyl)pentanamide CAS Name: 2-amino-5-(diaminomethylideneamino)-N-(1-oxo-2,2-diphenylethyl)-N-(pyridin-4-ylmethyl)pentanamide IUPAC Name: 2-amino-5-(diaminomethylideneamino)-N-(2,2-diphenylacetyl)-N-(pyridin-4-ylmethyl)pentanamide Traditional Name: 2-amino-N-(2,2-diphenylacetyl)-5-guanidino-N-(4-pyridylmethyl)valeramide Formula: C26H30N6O2 MolecularWeight: 458.5554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N(CC3=CC=NC=C3)C(=O)C(CCCN=C(N)N)N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)N(CC3=CC=NC=C3)C(=O)C(CCCN=C(N)N)N

InChI

InChI=1S/C26H30N6O2/c27-22(12-7-15-31-26(28)29)24(33)32(18-19-13-16-30-17-14-19)25(34)23(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h1-6,8-11,13-14,16-17,22-23H,7,12,15,18,27H2,(H4,28,29,31)