3-methylsulfanyl-1-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]propan-1-one

Systemtic Name: 3-methylsulfanyl-1-[2-[2-(4-methylsulfonylphenyl)ethanoyl]pyrazolidin-1-yl]propan-1-one Openeye Name: 3-methylsulfanyl-1-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]propan-1-one CAS Name: 1-[2-[2-(4-methylsulfonylphenyl)-1-oxoethyl]-1-pyrazolidinyl]-3-(methylthio)-1-propanone IUPAC Name: 3-methylsulfanyl-1-[2-[2-(4-methylsulfonylphenyl)acetyl]pyrazolidin-1-yl]propan-1-one Traditional Name: 1-[2-[2-(4-mesylphenyl)acetyl]pyrazolidin-1-yl]-3-(methylthio)propan-1-one Formula: C16H22N2O4S2 MolecularWeight: 370.48688

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CSCCC(=O)N1CCCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H22N2O4S2/c1-23-11-8-15(19)17-9-3-10-18(17)16(20)12-13-4-6-14(7-5-13)24(2,21)22/h4-7H,3,8-12H2,1-2H3