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

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

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