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

Systemtic Name: 3-nitro-N-[5-(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3-nitro-N-[5-(5-oxo-1-phenyl-pyrrolidin-3-yl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3-nitro-N-[5-(5-oxo-1-phenyl-3-pyrrolidinyl)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3-nitro-N-[5-(5-oxo-1-phenylpyrrolidin-3-yl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: N-[5-(5-keto-1-phenyl-pyrrolidin-3-yl)-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C19H15N5O4S MolecularWeight: 409.4185

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC=C2)C3=NN=C(S3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(CN(C1=O)C2=CC=CC=C2)C3=NN=C(S3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H15N5O4S/c25-16-10-13(11-23(16)14-6-2-1-3-7-14)18-21-22-19(29-18)20-17(26)12-5-4-8-15(9-12)24(27)28/h1-9,13H,10-11H2,(H,20,22,26)