N-[(2S)-3-oxidanyl-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[(2S)-3-oxidanyl-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(1S)-1-(hydroxymethyl)-2-oxo-2-(thiazol-2-ylamino)ethyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(2S)-3-hydroxy-1-oxo-1-(2-thiazolylamino)propan-2-yl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(2S)-3-hydroxy-1-oxo-1-(1,3-thiazol-2-ylamino)propan-2-yl]-3H-benzimidazole-5-carboxamide Traditional Name: N-[(1S)-2-keto-1-methylol-2-(thiazol-2-ylamino)ethyl]-3H-benzimidazole-5-carboxamide Formula: C14H13N5O3S MolecularWeight: 331.34972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)NC(CO)C(=O)NC3=NC=CS3)NC=N2

Isomeric SMILES

C1=CC2=C(C=C1C(=O)N[C@@H](CO)C(=O)NC3=NC=CS3)NC=N2

InChI

InChI=1S/C14H13N5O3S/c20-6-11(13(22)19-14-15-3-4-23-14)18-12(21)8-1-2-9-10(5-8)17-7-16-9/h1-5,7,11,20H,6H2,(H,16,17)(H,18,21)(H,15,19,22)/t11-/m0/s1