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

Systemtic Name: 1-(4-acetamidophenyl)-5-oxidanylidene-N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-3-carboxamide Openeye Name: 1-(4-acetamidophenyl)-N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(4-acetamidophenyl)-5-oxo-N-[5-[(phenylmethylthio)methyl]-1,3,4-thiadiazol-2-yl]-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-acetamidophenyl)-N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(4-acetamidophenyl)-N-[5-[(benzylthio)methyl]-1,3,4-thiadiazol-2-yl]-5-keto-pyrrolidine-3-carboxamide Formula: C23H23N5O3S2 MolecularWeight: 481.59042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSCC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NN=C(S3)CSCC4=CC=CC=C4

InChI

InChI=1S/C23H23N5O3S2/c1-15(29)24-18-7-9-19(10-8-18)28-12-17(11-21(28)30)22(31)25-23-27-26-20(33-23)14-32-13-16-5-3-2-4-6-16/h2-10,17H,11-14H2,1H3,(H,24,29)(H,25,27,31)