N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-[2-(4-fluorophenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-[2-(4-fluorophenyl)ethyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-[2-(4-fluorophenyl)ethyl]-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-[2-(4-fluorophenyl)ethyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-1-[2-(4-fluorophenyl)ethyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-[2-(4-fluorophenyl)ethyl]-5-keto-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Formula: C19H23FN4O2S2 MolecularWeight: 422.539923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)C2CC(=O)N(C2)CCC3=CC=C(C=C3)F

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)C2CC(=O)N(C2)CCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H23FN4O2S2/c1-3-12(2)27-19-23-22-18(28-19)21-17(26)14-10-16(25)24(11-14)9-8-13-4-6-15(20)7-5-13/h4-7,12,14H,3,8-11H2,1-2H3,(H,21,22,26)