4-nitro-N-[5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-nitro-N-[5-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-nitro-N-[5-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-nitro-N-[5-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-nitro-N-[5-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanyl-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-[(2-keto-2-pyrrolidino-ethyl)thio]-1,3,4-thiadiazol-2-yl]-4-nitro-benzamide Formula: C15H15N5O4S2 MolecularWeight: 393.4407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O4S2/c21-12(19-7-1-2-8-19)9-25-15-18-17-14(26-15)16-13(22)10-3-5-11(6-4-10)20(23)24/h3-6H,1-2,7-9H2,(H,16,17,22)