N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-phenylsulfanylethanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-phenylsulfanylethanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-phenylsulfanylacetyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-[1-oxo-2-(phenylthio)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-(2-phenylsulfanylacetyl)pyrrolidine-2-carboxamide Traditional Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-[2-(phenylthio)acetyl]pyrrolidine-2-carboxamide Formula: C22H22N4O3S2 MolecularWeight: 454.56508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)CSC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(S2)NC(=O)C3CCCN3C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C22H22N4O3S2/c1-29-16-8-5-7-15(13-16)21-24-25-22(31-21)23-20(28)18-11-6-12-26(18)19(27)14-30-17-9-3-2-4-10-17/h2-5,7-10,13,18H,6,11-12,14H2,1H3,(H,23,25,28)