[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methanethiol

Systemtic Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methanethiol Openeye Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methanethiol CAS Name: [1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinyl]methanethiol IUPAC Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methanethiol Traditional Name: [1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methanethiol Formula: C12H17NO3S2 MolecularWeight: 287.39828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CS

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CS

InChI

InChI=1S/C12H17NO3S2/c1-16-11-4-6-12(7-5-11)18(14,15)13-8-2-3-10(13)9-17/h4-7,10,17H,2-3,8-9H2,1H3