N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[(1R)-1-(4-mesylphenyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C18H21NO3S2 MolecularWeight: 363.49424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CSC3=C2CCCC3

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CSC3=C2CCCC3

InChI

InChI=1S/C18H21NO3S2/c1-12(13-7-9-14(10-8-13)24(2,21)22)19-18(20)16-11-23-17-6-4-3-5-15(16)17/h7-12H,3-6H2,1-2H3,(H,19,20)/t12-/m1/s1