N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-4-methoxy-3-sulfamoyl-benzamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-4-methoxy-3-sulfamoyl-benzamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-4-methoxy-3-sulfamoyl-benzamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-4-methoxy-3-sulfamoylbenzamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-4-methoxy-3-sulfamoylbenzamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-4-methoxy-3-sulfamoyl-benzamide Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N

InChI

InChI=1S/C22H22N2O4S2/c1-14-4-5-15(2)20(12-14)29-18-9-7-17(8-10-18)24-22(25)16-6-11-19(28-3)21(13-16)30(23,26)27/h4-13H,1-3H3,(H,24,25)(H2,23,26,27)