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

Systemtic Name: 1-(3-methylphenyl)-5-oxidanylidene-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Openeye Name: 1-(m-tolyl)-5-oxo-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide CAS Name: 1-(3-methylphenyl)-5-oxo-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(3-methylphenyl)-5-oxo-N-[5-(phenylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Traditional Name: 5-keto-1-(m-tolyl)-N-[5-[(phenylthio)methyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Formula: C21H20N4O2S2 MolecularWeight: 424.5391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S2/c1-14-6-5-7-16(10-14)25-12-15(11-19(25)26)20(27)22-21-24-23-18(29-21)13-28-17-8-3-2-4-9-17/h2-10,15H,11-13H2,1H3,(H,22,24,27)