(2S)-3-oxidanyl-2-(2-phenylethanoylamino)-N-(1,2,4-triazol-4-yl)propanamide

Systemtic Name: (2S)-3-oxidanyl-2-(2-phenylethanoylamino)-N-(1,2,4-triazol-4-yl)propanamide Openeye Name: (2S)-3-hydroxy-2-[(2-phenylacetyl)amino]-N-(1,2,4-triazol-4-yl)propanamide CAS Name: (2S)-3-hydroxy-2-[(1-oxo-2-phenylethyl)amino]-N-(1,2,4-triazol-4-yl)propanamide IUPAC Name: (2S)-3-hydroxy-2-[(2-phenylacetyl)amino]-N-(1,2,4-triazol-4-yl)propanamide Traditional Name: (2S)-3-hydroxy-2-[(2-phenylacetyl)amino]-N-(1,2,4-triazol-4-yl)propionamide Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(CO)C(=O)NN2C=NN=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)N[C@@H](CO)C(=O)NN2C=NN=C2

InChI

InChI=1S/C13H15N5O3/c19-7-11(13(21)17-18-8-14-15-9-18)16-12(20)6-10-4-2-1-3-5-10/h1-5,8-9,11,19H,6-7H2,(H,16,20)(H,17,21)/t11-/m0/s1