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

Systemtic Name: N-[5-[1-(4-methoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[5-[1-(4-methoxyphenyl)-5-oxo-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide CAS Name: N-[5-[1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinyl]-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide IUPAC Name: N-[5-[1-(4-methoxyphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[5-[5-keto-1-(4-methoxyphenyl)pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]-3-nitro-benzamide Formula: C20H17N5O5S MolecularWeight: 439.44448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O5S/c1-30-16-7-5-14(6-8-16)24-11-13(10-17(24)26)19-22-23-20(31-19)21-18(27)12-3-2-4-15(9-12)25(28)29/h2-9,13H,10-11H2,1H3,(H,21,23,27)