N-(6-methyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-(besylmethyl)-N-(6-methyl-1,3-benzothiazol-2-yl)benzamide Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)CS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)CS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H18N2O3S2/c1-15-10-11-19-20(12-15)28-22(23-19)24-21(25)17-7-5-6-16(13-17)14-29(26,27)18-8-3-2-4-9-18/h2-13H,14H2,1H3,(H,23,24,25)