N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(phenylmethyl)benzamide

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-methylsulfonyl-benzamide CAS Name: 4-methylsulfonyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)-4-methylsulfonylbenzamide Traditional Name: N-benzyl-4-mesyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C23H20N2O3S3 MolecularWeight: 468.6115

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CSC1=CC2=C(C=C1)N=C(S2)N(CC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C23H20N2O3S3/c1-29-18-10-13-20-21(14-18)30-23(24-20)25(15-16-6-4-3-5-7-16)22(26)17-8-11-19(12-9-17)31(2,27)28/h3-14H,15H2,1-2H3