2-(2-methoxyethylsulfanyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 2-(2-methoxyethylsulfanyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 2-(2-methoxyethylsulfanyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 2-(2-methoxyethylthio)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 2-(2-methoxyethylsulfanyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-2-(2-methoxyethylthio)benzamide Formula: C18H18N2O4S3 MolecularWeight: 422.54152

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COCCSC1=CC=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H18N2O4S3/c1-24-9-10-25-15-6-4-3-5-13(15)17(21)20-18-19-14-8-7-12(27(2,22)23)11-16(14)26-18/h3-8,11H,9-10H2,1-2H3,(H,19,20,21)