N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(3-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(3-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(m-tolyl)-5-oxo-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-3-carboxamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-1-(3-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 5-keto-1-(m-tolyl)-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Formula: C18H22N4O2S2 MolecularWeight: 390.52288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)C2CC(=O)N(C2)C3=CC=CC(=C3)C

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)C2CC(=O)N(C2)C3=CC=CC(=C3)C

InChI

InChI=1S/C18H22N4O2S2/c1-4-12(3)25-18-21-20-17(26-18)19-16(24)13-9-15(23)22(10-13)14-7-5-6-11(2)8-14/h5-8,12-13H,4,9-10H2,1-3H3,(H,19,20,24)