2-azanyl-3-methyl-N-[3-methyl-1-oxidanylidene-1-(pyridin-2-ylmethylamino)butan-2-yl]pentanamide dihydrochloride

Systemtic Name: 2-azanyl-3-methyl-N-[3-methyl-1-oxidanylidene-1-(pyridin-2-ylmethylamino)butan-2-yl]pentanamide dihydrochloride Openeye Name: 2-amino-3-methyl-N-[2-methyl-1-(2-pyridylmethylcarbamoyl)propyl]pentanamide dihydrochloride CAS Name: 2-amino-3-methyl-N-[3-methyl-1-oxo-1-(2-pyridinylmethylamino)butan-2-yl]pentanamide dihydrochloride IUPAC Name: 2-amino-3-methyl-N-[3-methyl-1-oxo-1-(pyridin-2-ylmethylamino)butan-2-yl]pentanamide dihydrochloride Traditional Name: 2-amino-3-methyl-N-[2-methyl-1-(2-pyridylmethylcarbamoyl)propyl]valeramide dihydrochloride Formula: C17H30Cl2N4O2 MolecularWeight: 393.3517

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)C)C(=O)NCC1=CC=CC=N1)N.Cl.Cl

Isomeric SMILES

CCC(C)C(C(=O)NC(C(C)C)C(=O)NCC1=CC=CC=N1)N.Cl.Cl

InChI

InChI=1S/C17H28N4O2.2ClH/c1-5-12(4)14(18)16(22)21-15(11(2)3)17(23)20-10-13-8-6-7-9-19-13;;/h6-9,11-12,14-15H,5,10,18H2,1-4H3,(H,20,23)(H,21,22);2*1H