1-(2-ethylphenyl)-5-oxidanylidene-N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide

Systemtic Name: 1-(2-ethylphenyl)-5-oxidanylidene-N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Openeye Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-1-(2-ethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(2-ethylphenyl)-5-oxo-N-[5-[(phenylmethylthio)methyl]-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[5-[(benzylthio)methyl]-1,3,4-thiadiazol-2-yl]-1-(2-ethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSCC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSCC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O2S2/c1-2-17-10-6-7-11-19(17)27-13-18(12-21(27)28)22(29)24-23-26-25-20(31-23)15-30-14-16-8-4-3-5-9-16/h3-11,18H,2,12-15H2,1H3,(H,24,26,29)