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

Systemtic Name: N-(2-methyl-5-methylsulfonyl-phenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: N-(2-methyl-5-methylsulfonyl-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: N-(2-methyl-5-methylsulfonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: N-(2-methyl-5-methylsulfonylphenyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C17H19NO3S2 MolecularWeight: 349.46766

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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)CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C17H19NO3S2/c1-11-7-8-13(23(2,20)21)10-14(11)18-17(19)16-9-12-5-3-4-6-15(12)22-16/h7-10H,3-6H2,1-2H3,(H,18,19)