N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-methylsulfonyl-benzamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-methylsulfonyl-benzamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-methylsulfonyl-benzamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-methylsulfonylbenzamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-methylsulfonylbenzamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-mesyl-benzamide Formula: C22H18N2O3S2 MolecularWeight: 422.51992

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

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