N-(furan-2-ylmethyl)-2-methylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2-methylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: N-(2-furylmethyl)-2-methylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: N-(2-furanylmethyl)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-2-(methylthio)benzamide IUPAC Name: N-(furan-2-ylmethyl)-2-methylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-(2-furfuryl)-N-(4-mesyl-1,3-benzothiazol-2-yl)-2-(methylthio)benzamide Formula: C21H18N2O4S3 MolecularWeight: 458.57362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N(CC2=CC=CO2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C21H18N2O4S3/c1-28-16-9-4-3-8-15(16)20(24)23(13-14-7-6-12-27-14)21-22-19-17(29-21)10-5-11-18(19)30(2,25)26/h3-12H,13H2,1-2H3