1-(4-methoxyphenyl)sulfonyl-4-oxidanyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-4-oxidanyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-4-hydroxy-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: 4-hydroxy-1-(4-methoxyphenyl)sulfonyl-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-2-pyrrolidinecarboxamide IUPAC Name: 4-hydroxy-1-(4-methoxyphenyl)sulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-4-hydroxy-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C17H20N4O5S3 MolecularWeight: 456.5595

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)NC3=NN=C(S3)SCC=C)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C(=O)NC3=NN=C(S3)SCC=C)O

InChI

InChI=1S/C17H20N4O5S3/c1-3-8-27-17-20-19-16(28-17)18-15(23)14-9-11(22)10-21(14)29(24,25)13-6-4-12(26-2)5-7-13/h3-7,11,14,22H,1,8-10H2,2H3,(H,18,19,23)