(2S)-1-[(3R)-3-azanyl-4-phenyl-butanoyl]-N-[1-(5-oxidanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(3R)-3-azanyl-4-phenyl-butanoyl]-N-[1-(5-oxidanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[(3R)-3-amino-4-phenyl-butanoyl]-N-[1-(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[(3R)-3-amino-1-oxo-4-phenylbutyl]-N-[1-(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[(3R)-3-amino-4-phenylbutanoyl]-N-[1-(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[(3R)-3-amino-4-phenyl-butanoyl]-N-[1-(5-keto-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]pyrrolidine-2-carboxamide Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)NN1)NC(=O)C2CCCN2C(=O)CC(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C1=NC(=O)NN1)NC(=O)[C@@H]2CCCN2C(=O)C[C@@H](CC3=CC=CC=C3)N

InChI

InChI=1S/C19H26N6O3/c1-12(17-22-19(28)24-23-17)21-18(27)15-8-5-9-25(15)16(26)11-14(20)10-13-6-3-2-4-7-13/h2-4,6-7,12,14-15H,5,8-11,20H2,1H3,(H,21,27)(H2,22,23,24,28)/t12?,14-,15+/m1/s1