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

Systemtic Name: 4-chloranyl-3-nitro-N-[(2S)-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)propan-2-yl]benzamide Openeye Name: 4-chloro-N-[(1S)-1-methyl-2-oxo-2-(thiazol-2-ylamino)ethyl]-3-nitro-benzamide CAS Name: 4-chloro-3-nitro-N-[(2S)-1-oxo-1-(2-thiazolylamino)propan-2-yl]benzamide IUPAC Name: 4-chloro-3-nitro-N-[(2S)-1-oxo-1-(1,3-thiazol-2-ylamino)propan-2-yl]benzamide Traditional Name: 4-chloro-N-[(1S)-2-keto-1-methyl-2-(thiazol-2-ylamino)ethyl]-3-nitro-benzamide Formula: C13H11ClN4O4S MolecularWeight: 354.76884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN4O4S/c1-7(11(19)17-13-15-4-5-23-13)16-12(20)8-2-3-9(14)10(6-8)18(21)22/h2-7H,1H3,(H,16,20)(H,15,17,19)/t7-/m0/s1