7-methoxy-N-(2-methyl-5-methylsulfonyl-phenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: 7-methoxy-N-(2-methyl-5-methylsulfonyl-phenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: 7-methoxy-N-(2-methyl-5-methylsulfonyl-phenyl)-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: 7-methoxy-N-(2-methyl-5-methylsulfonylphenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: 7-methoxy-N-(2-methyl-5-methylsulfonylphenyl)-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C22H21NO4S2 MolecularWeight: 427.53644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC3=C(S2)C4=C(CC3)C=C(C=C4)OC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC3=C(S2)C4=C(CC3)C=C(C=C4)OC

InChI

InChI=1S/C22H21NO4S2/c1-13-4-8-17(29(3,25)26)12-19(13)23-22(24)20-11-15-6-5-14-10-16(27-2)7-9-18(14)21(15)28-20/h4,7-12H,5-6H2,1-3H3,(H,23,24)