3-nitro-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide

Systemtic Name: 3-nitro-4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide Openeye Name: 3-nitro-4-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]benzamide IUPAC Name: 3-nitro-4-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzamide Traditional Name: 4-[(2-keto-2-pyrrolidino-ethyl)thio]-3-nitro-benzamide Formula: C13H15N3O4S MolecularWeight: 309.3409

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c14-13(18)9-3-4-11(10(7-9)16(19)20)21-8-12(17)15-5-1-2-6-15/h3-4,7H,1-2,5-6,8H2,(H2,14,18)