5-methyl-N-(2-methyl-5-methylsulfonyl-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-methyl-N-(2-methyl-5-methylsulfonyl-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-methyl-N-(2-methyl-5-methylsulfonyl-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-methyl-N-(2-methyl-5-methylsulfonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-methyl-N-(2-methyl-5-methylsulfonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)C

InChI

InChI=1S/C18H21NO3S2/c1-11-4-7-16-13(8-11)9-17(23-16)18(20)19-15-10-14(24(3,21)22)6-5-12(15)2/h5-6,9-11H,4,7-8H2,1-3H3,(H,19,20)