N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methylsulfonyl-benzamide

Systemtic Name: N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methylsulfonyl-benzamide Openeye Name: N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methylsulfonyl-benzamide CAS Name: 3-methylsulfonyl-N-[3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]benzamide IUPAC Name: N-[3-(2-methylsulfanylethyl)-1,3-benzothiazol-2-ylidene]-3-methylsulfonylbenzamide Traditional Name: 3-mesyl-N-[3-[2-(methylthio)ethyl]-1,3-benzothiazol-2-ylidene]benzamide Formula: C18H18N2O3S3 MolecularWeight: 406.54212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CSCCN1C2=CC=CC=C2SC1=NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C18H18N2O3S3/c1-24-11-10-20-15-8-3-4-9-16(15)25-18(20)19-17(21)13-6-5-7-14(12-13)26(2,22)23/h3-9,12H,10-11H2,1-2H3