5-bromanyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-methyl-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-methyl-benzenesulfonamide Openeye Name: 5-bromo-2-methyl-N-[(4S)-thiochroman-4-yl]benzenesulfonamide CAS Name: 5-bromo-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-2-methylbenzenesulfonamide IUPAC Name: 5-bromo-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-2-methylbenzenesulfonamide Traditional Name: 5-bromo-2-methyl-N-[(4S)-thiochroman-4-yl]benzenesulfonamide Formula: C16H16BrNO2S2 MolecularWeight: 398.33774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)S(=O)(=O)NC2CCSC3=CC=CC=C23

Isomeric SMILES

CC1=C(C=C(C=C1)Br)S(=O)(=O)N[C@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C16H16BrNO2S2/c1-11-6-7-12(17)10-16(11)22(19,20)18-14-8-9-21-15-5-3-2-4-13(14)15/h2-7,10,14,18H,8-9H2,1H3/t14-/m0/s1