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

Systemtic Name: 4-ethylsulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 4-ethylsulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-ethylsulfonyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide IUPAC Name: 4-ethylsulfonyl-N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 4-esyl-N-[6-(methylthio)-1,3-benzothiazol-2-yl]benzamide Formula: C17H16N2O3S3 MolecularWeight: 392.51554

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)SC

InChI

InChI=1S/C17H16N2O3S3/c1-3-25(21,22)13-7-4-11(5-8-13)16(20)19-17-18-14-9-6-12(23-2)10-15(14)24-17/h4-10H,3H2,1-2H3,(H,18,19,20)