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

Systemtic Name: 1-(4-ethylphenyl)-5-oxidanylidene-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Openeye Name: 1-(4-ethylphenyl)-5-oxo-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide CAS Name: 1-(4-ethylphenyl)-5-oxo-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-ethylphenyl)-5-oxo-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Traditional Name: 1-(4-ethylphenyl)-5-keto-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Formula: C22H22N4O2S2 MolecularWeight: 438.56568

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O2S2/c1-2-15-8-10-17(11-9-15)26-13-16(12-20(26)27)21(28)23-22-25-24-19(30-22)14-29-18-6-4-3-5-7-18/h3-11,16H,2,12-14H2,1H3,(H,23,25,28)