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

Systemtic Name: tert-butyl N-[2-(4-oxidanylidene-1-thiophen-2-ylsulfonyl-piperidin-3-yl)sulfanylethyl]carbamate Openeye Name: tert-butyl N-[2-[[4-oxo-1-(2-thienylsulfonyl)-3-piperidyl]sulfanyl]ethyl]carbamate CAS Name: N-[2-[(4-oxo-1-thiophen-2-ylsulfonyl-3-piperidinyl)thio]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(4-oxo-1-thiophen-2-ylsulfonylpiperidin-3-yl)sulfanylethyl]carbamate Traditional Name: N-[2-[[4-keto-1-(2-thienylsulfonyl)-3-piperidyl]thio]ethyl]carbamic acid tert-butyl ester Formula: C16H24N2O5S3 MolecularWeight: 420.56716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCSC1CN(CCC1=O)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)(C)OC(=O)NCCSC1CN(CCC1=O)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H24N2O5S3/c1-16(2,3)23-15(20)17-7-10-24-13-11-18(8-6-12(13)19)26(21,22)14-5-4-9-25-14/h4-5,9,13H,6-8,10-11H2,1-3H3,(H,17,20)