N-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(p-tolylsulfonylmethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-[(4-methylphenyl)sulfonylmethyl]benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(tosylmethyl)benzamide Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

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