[1-(4-methylphenyl)sulfonylpyrrol-3-yl]methanethiol

Systemtic Name: [1-(4-methylphenyl)sulfonylpyrrol-3-yl]methanethiol Openeye Name: [1-(p-tolylsulfonyl)pyrrol-3-yl]methanethiol CAS Name: [1-(4-methylphenyl)sulfonyl-3-pyrrolyl]methanethiol IUPAC Name: [1-(4-methylphenyl)sulfonylpyrrol-3-yl]methanethiol Traditional Name: (1-tosylpyrrol-3-yl)methanethiol Formula: C12H13NO2S2 MolecularWeight: 267.36712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)CS

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)CS

InChI

InChI=1S/C12H13NO2S2/c1-10-2-4-12(5-3-10)17(14,15)13-7-6-11(8-13)9-16/h2-8,16H,9H2,1H3