N-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)butan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2R)-4-methylsulfanyl-1-oxidanylidene-1-(1,3-thiazol-2-ylamino)butan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1R)-3-methylsulfanyl-1-(thiazol-2-ylcarbamoyl)propyl]-3-nitro-benzamide CAS Name: N-[(2R)-4-(methylthio)-1-oxo-1-(2-thiazolylamino)butan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2R)-4-methylsulfanyl-1-oxo-1-(1,3-thiazol-2-ylamino)butan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1R)-3-(methylthio)-1-(thiazol-2-ylcarbamoyl)propyl]-3-nitro-benzamide Formula: C15H16N4O4S2 MolecularWeight: 380.44194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N4O4S2/c1-24-7-5-12(14(21)18-15-16-6-8-25-15)17-13(20)10-3-2-4-11(9-10)19(22)23/h2-4,6,8-9,12H,5,7H2,1H3,(H,17,20)(H,16,18,21)/t12-/m1/s1