1-(2-azanyl-3-phenyl-propanoyl)-N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]pyrrolidine-2-carboxamide dihydrochloride

Systemtic Name: 1-(2-azanyl-3-phenyl-propanoyl)-N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]pyrrolidine-2-carboxamide dihydrochloride Openeye Name: 1-(2-amino-3-phenyl-propanoyl)-N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]pyrrolidine-2-carboxamide dihydrochloride CAS Name: 1-(2-amino-1-oxo-3-phenylpropyl)-N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]-2-pyrrolidinecarboxamide dihydrochloride IUPAC Name: 1-(2-amino-3-phenylpropanoyl)-N-[[2-(1,2,4-triazol-1-yl)phenyl]methyl]pyrrolidine-2-carboxamide dihydrochloride Traditional Name: 1-phenylalanyl-N-[2-(1,2,4-triazol-1-yl)benzyl]pyrrolidine-2-carboxamide dihydrochloride Formula: C23H28Cl2N6O2 MolecularWeight: 491.41342

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)C(=O)NCC3=CC=CC=C3N4C=NC=N4.Cl.Cl

Isomeric SMILES

C1CC(N(C1)C(=O)C(CC2=CC=CC=C2)N)C(=O)NCC3=CC=CC=C3N4C=NC=N4.Cl.Cl

InChI

InChI=1S/C23H26N6O2.2ClH/c24-19(13-17-7-2-1-3-8-17)23(31)28-12-6-11-21(28)22(30)26-14-18-9-4-5-10-20(18)29-16-25-15-27-29;;/h1-5,7-10,15-16,19,21H,6,11-14,24H2,(H,26,30);2*1H