2-[(4-methylphenyl)sulfonylamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-phenyl-2-(p-tolylsulfonylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-phenyl-2-(tosylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3S2/c1-15-11-13-17(14-12-15)29(26,27)24-22-20(18-9-5-6-10-19(18)28-22)21(25)23-16-7-3-2-4-8-16/h2-4,7-8,11-14,24H,5-6,9-10H2,1H3,(H,23,25)