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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)SC)SC1=NC(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

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