N-(3,4-dihydro-2H-thiochromen-4-yl)-4-[(2-methylphenyl)sulfamoyl]benzamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-4-[(2-methylphenyl)sulfamoyl]benzamide Openeye Name: 4-(o-tolylsulfamoyl)-N-thiochroman-4-yl-benzamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-4-[(2-methylphenyl)sulfamoyl]benzamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-4-[(2-methylphenyl)sulfamoyl]benzamide Traditional Name: 4-(o-tolylsulfamoyl)-N-thiochroman-4-yl-benzamide Formula: C23H22N2O3S2 MolecularWeight: 438.56238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC3CCSC4=CC=CC=C34

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NC3CCSC4=CC=CC=C34

InChI

InChI=1S/C23H22N2O3S2/c1-16-6-2-4-8-20(16)25-30(27,28)18-12-10-17(11-13-18)23(26)24-21-14-15-29-22-9-5-3-7-19(21)22/h2-13,21,25H,14-15H2,1H3,(H,24,26)