3-[(4-methylphenyl)sulfanylmethyl]-5-(4-methylsulfonyl-3-pyrrol-1-yl-thiophen-2-yl)-1,3,4-oxadiazol-2-one

Systemtic Name: 3-[(4-methylphenyl)sulfanylmethyl]-5-(4-methylsulfonyl-3-pyrrol-1-yl-thiophen-2-yl)-1,3,4-oxadiazol-2-one Openeye Name: 5-(4-methylsulfonyl-3-pyrrol-1-yl-2-thienyl)-3-(p-tolylsulfanylmethyl)-1,3,4-oxadiazol-2-one CAS Name: 3-[[(4-methylphenyl)thio]methyl]-5-[4-methylsulfonyl-3-(1-pyrrolyl)-2-thiophenyl]-1,3,4-oxadiazol-2-one IUPAC Name: 3-[(4-methylphenyl)sulfanylmethyl]-5-(4-methylsulfonyl-3-pyrrol-1-ylthiophen-2-yl)-1,3,4-oxadiazol-2-one Traditional Name: 5-(4-mesyl-3-pyrrol-1-yl-2-thienyl)-3-[(p-tolylthio)methyl]-1,3,4-oxadiazol-2-one Formula: C19H17N3O4S3 MolecularWeight: 447.55098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCN2C(=O)OC(=N2)C3=C(C(=CS3)S(=O)(=O)C)N4C=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SCN2C(=O)OC(=N2)C3=C(C(=CS3)S(=O)(=O)C)N4C=CC=C4

InChI

InChI=1S/C19H17N3O4S3/c1-13-5-7-14(8-6-13)28-12-22-19(23)26-18(20-22)17-16(21-9-3-4-10-21)15(11-27-17)29(2,24)25/h3-11H,12H2,1-2H3