N-[1-(4-methoxyphenyl)ethyl]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[1-(4-methoxyphenyl)ethyl]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-(1,1-dimethylpropyl)-N-[1-(4-methoxyphenyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[1-(4-methoxyphenyl)ethyl]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[1-(4-methoxyphenyl)ethyl]-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-tert-amyl-N-[1-(4-methoxyphenyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H31NO2S MolecularWeight: 385.56274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C1)SC=C2C(=O)NC(C)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(C)(C)C1CCC2=C(C1)SC=C2C(=O)NC(C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H31NO2S/c1-6-23(3,4)17-9-12-19-20(14-27-21(19)13-17)22(25)24-15(2)16-7-10-18(26-5)11-8-16/h7-8,10-11,14-15,17H,6,9,12-13H2,1-5H3,(H,24,25)