N-[(2S)-2-tert-butylthian-1-ylidene]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2S)-2-tert-butylthian-1-ylidene]-4-methyl-benzenesulfonamide Openeye Name: N-[(2S)-2-tert-butylthian-1-ylidene]-4-methyl-benzenesulfonamide CAS Name: N-[(2S)-2-tert-butyl-1-thianylidene]-4-methylbenzenesulfonamide IUPAC Name: N-[(2S)-2-tert-butylthian-1-ylidene]-4-methylbenzenesulfonamide Traditional Name: N-[(2S)-2-tert-butylthian-1-ylidene]-4-methyl-benzenesulfonamide Formula: C16H25NO2S2 MolecularWeight: 327.5052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=S2CCCCC2C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=S2CCCC[C@H]2C(C)(C)C

InChI

InChI=1S/C16H25NO2S2/c1-13-8-10-14(11-9-13)21(18,19)17-20-12-6-5-7-15(20)16(2,3)4/h8-11,15H,5-7,12H2,1-4H3/t15-,20?/m0/s1