N-(3,4-dihydro-2H-thiochromen-4-yl)-2-methyl-5-methylsulfonyl-benzamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-methyl-5-methylsulfonyl-benzamide Openeye Name: 2-methyl-5-methylsulfonyl-N-thiochroman-4-yl-benzamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-methyl-5-methylsulfonylbenzamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-2-methyl-5-methylsulfonylbenzamide Traditional Name: 5-mesyl-2-methyl-N-thiochroman-4-yl-benzamide Formula: C18H19NO3S2 MolecularWeight: 361.47836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO3S2/c1-12-7-8-13(24(2,21)22)11-15(12)18(20)19-16-9-10-23-17-6-4-3-5-14(16)17/h3-8,11,16H,9-10H2,1-2H3,(H,19,20)