N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-(phenylsulfonylmethyl)benzamide Openeye Name: 4-(benzenesulfonylmethyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-(benzenesulfonylmethyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 4-(benzenesulfonylmethyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-(besylmethyl)-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=O)C3=CC=C(C=C3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3S2/c1-15-7-12-19-20(13-15)28-22(23-19)24-21(25)17-10-8-16(9-11-17)14-29(26,27)18-5-3-2-4-6-18/h2-6,8-11,15H,7,12-14H2,1H3,(H,23,24,25)