tert-butyl N-[2-[1-(4-methylphenyl)sulfonyl-4-oxidanylidene-piperidin-3-yl]sulfanylethyl]carbamate

Systemtic Name: tert-butyl N-[2-[1-(4-methylphenyl)sulfonyl-4-oxidanylidene-piperidin-3-yl]sulfanylethyl]carbamate Openeye Name: tert-butyl N-[2-[[4-oxo-1-(p-tolylsulfonyl)-3-piperidyl]sulfanyl]ethyl]carbamate CAS Name: N-[2-[[1-(4-methylphenyl)sulfonyl-4-oxo-3-piperidinyl]thio]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[1-(4-methylphenyl)sulfonyl-4-oxopiperidin-3-yl]sulfanylethyl]carbamate Traditional Name: N-[2-[(4-keto-1-tosyl-3-piperidyl)thio]ethyl]carbamic acid tert-butyl ester Formula: C19H28N2O5S2 MolecularWeight: 428.56602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)C(C2)SCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(=O)C(C2)SCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C19H28N2O5S2/c1-14-5-7-15(8-6-14)28(24,25)21-11-9-16(22)17(13-21)27-12-10-20-18(23)26-19(2,3)4/h5-8,17H,9-13H2,1-4H3,(H,20,23)