3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzo[g][1]benzofuran-2-carboxamide

Systemtic Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzo[g][1]benzofuran-2-carboxamide Openeye Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzo[g]benzofuran-2-carboxamide CAS Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-benzo[g]benzofurancarboxamide IUPAC Name: 3-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzo[g][1]benzofuran-2-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3-methyl-benzo[g]benzofuran-2-carboxamide Formula: C22H16N2O4S2 MolecularWeight: 436.50344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CC1=C(OC2=C1C=CC3=CC=CC=C32)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C22H16N2O4S2/c1-12-15-9-7-13-5-3-4-6-16(13)20(15)28-19(12)21(25)24-22-23-17-10-8-14(30(2,26)27)11-18(17)29-22/h3-11H,1-2H3,(H,23,24,25)