2-oxidanyl-N-[(2S)-3-oxidanyl-1-oxidanylidene-1-(1,2,4-triazol-4-ylamino)propan-2-yl]-5-pyrrol-1-yl-benzamide

Systemtic Name: 2-oxidanyl-N-[(2S)-3-oxidanyl-1-oxidanylidene-1-(1,2,4-triazol-4-ylamino)propan-2-yl]-5-pyrrol-1-yl-benzamide Openeye Name: 2-hydroxy-N-[(1S)-1-(hydroxymethyl)-2-oxo-2-(1,2,4-triazol-4-ylamino)ethyl]-5-pyrrol-1-yl-benzamide CAS Name: 2-hydroxy-N-[(2S)-3-hydroxy-1-oxo-1-(1,2,4-triazol-4-ylamino)propan-2-yl]-5-(1-pyrrolyl)benzamide IUPAC Name: 2-hydroxy-N-[(2S)-3-hydroxy-1-oxo-1-(1,2,4-triazol-4-ylamino)propan-2-yl]-5-pyrrol-1-ylbenzamide Traditional Name: 2-hydroxy-N-[(1S)-2-keto-1-methylol-2-(1,2,4-triazol-4-ylamino)ethyl]-5-pyrrol-1-yl-benzamide Formula: C16H16N6O4 MolecularWeight: 356.33604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC(=C(C=C2)O)C(=O)NC(CO)C(=O)NN3C=NN=C3

Isomeric SMILES

C1=CN(C=C1)C2=CC(=C(C=C2)O)C(=O)N[C@@H](CO)C(=O)NN3C=NN=C3

InChI

InChI=1S/C16H16N6O4/c23-8-13(16(26)20-22-9-17-18-10-22)19-15(25)12-7-11(3-4-14(12)24)21-5-1-2-6-21/h1-7,9-10,13,23-24H,8H2,(H,19,25)(H,20,26)/t13-/m0/s1