2-(2,5-dimethylphenyl)sulfanyl-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone CAS Name: 2-[(2,5-dimethylphenyl)thio]-1-[4-(1-pyrrolidinylsulfonyl)phenyl]ethanone IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-1-(4-pyrrolidin-1-ylsulfonylphenyl)ethanone Traditional Name: 2-[(2,5-dimethylphenyl)thio]-1-(4-pyrrolidinosulfonylphenyl)ethanone Formula: C20H23NO3S2 MolecularWeight: 389.53152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H23NO3S2/c1-15-5-6-16(2)20(13-15)25-14-19(22)17-7-9-18(10-8-17)26(23,24)21-11-3-4-12-21/h5-10,13H,3-4,11-12,14H2,1-2H3