ethyl 2-[(1S)-1-(tert-butylsulfinylamino)-3-methyl-butyl]-1,3-dithiolane-2-carboxylate

Systemtic Name: ethyl 2-[(1S)-1-(tert-butylsulfinylamino)-3-methyl-butyl]-1,3-dithiolane-2-carboxylate Openeye Name: ethyl 2-[(1S)-1-(tert-butylsulfinylamino)-3-methyl-butyl]-1,3-dithiolane-2-carboxylate CAS Name: 2-[(1S)-1-(tert-butylsulfinylamino)-3-methylbutyl]-1,3-dithiolane-2-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(1S)-1-(tert-butylsulfinylamino)-3-methylbutyl]-1,3-dithiolane-2-carboxylate Traditional Name: 2-[(1S)-1-(tert-butylsulfinylamino)-3-methyl-butyl]-1,3-dithiolane-2-carboxylic acid ethyl ester Formula: C15H29NO3S3 MolecularWeight: 367.59066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(SCCS1)C(CC(C)C)NS(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1(SCCS1)[C@H](CC(C)C)NS(=O)C(C)(C)C

InChI

InChI=1S/C15H29NO3S3/c1-7-19-13(17)15(20-8-9-21-15)12(10-11(2)3)16-22(18)14(4,5)6/h11-12,16H,7-10H2,1-6H3/t12-,22?/m0/s1