3-nitro-N-[(2S)-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]benzamide

Systemtic Name: 3-nitro-N-[(2S)-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]benzamide Openeye Name: N-[(1S)-1-methyl-2-oxo-2-(thiazol-2-ylamino)ethyl]-3-nitro-benzamide CAS Name: 3-nitro-N-[(2S)-1-oxo-1-(2-thiazolylamino)propan-2-yl]benzamide IUPAC Name: 3-nitro-N-[(2S)-1-oxo-1-(1,3-thiazol-2-ylamino)propan-2-yl]benzamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-(thiazol-2-ylamino)ethyl]-3-nitro-benzamide Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=CS1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=CS1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O4S/c1-8(11(18)16-13-14-5-6-22-13)15-12(19)9-3-2-4-10(7-9)17(20)21/h2-8H,1H3,(H,15,19)(H,14,16,18)/t8-/m0/s1