(5S)-N-(5-tert-butyl-2-methoxy-phenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: (5S)-N-(5-tert-butyl-2-methoxy-phenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-(5-tert-butyl-2-methoxy-phenyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-(5-tert-butyl-2-methoxyphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-(5-tert-butyl-2-methoxyphenyl)-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-(5-tert-butyl-2-methoxy-phenyl)-5-methyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H27NO2S MolecularWeight: 357.50958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3=C(C=CC(=C3)C(C)(C)C)OC

InChI

InChI=1S/C21H27NO2S/c1-13-6-9-18-14(10-13)11-19(25-18)20(23)22-16-12-15(21(2,3)4)7-8-17(16)24-5/h7-8,11-13H,6,9-10H2,1-5H3,(H,22,23)/t13-/m0/s1