N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide

Systemtic Name: N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide Openeye Name: N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonyl-benzamide CAS Name: N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]-3-methylsulfonylbenzamide IUPAC Name: N-(3-methyl-6-methylsulfanyl-1,3-benzothiazol-2-ylidene)-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-[3-methyl-6-(methylthio)-1,3-benzothiazol-2-ylidene]benzamide Formula: C17H16N2O3S3 MolecularWeight: 392.51554

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

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