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

Systemtic Name: (5S)-N-(2-adamantyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: (5S)-N-(2-adamantyl)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: (5S)-N-(2-adamantyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: (5S)-N-(2-adamantyl)-5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: (5S)-N-(2-adamantyl)-5-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C23H33NOS MolecularWeight: 371.57922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3C4CC5CC(C4)CC3C5

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)C=C(S2)C(=O)NC3C4CC5CC(C4)CC3C5

InChI

InChI=1S/C23H33NOS/c1-23(2,3)18-4-5-19-15(11-18)12-20(26-19)22(25)24-21-16-7-13-6-14(9-16)10-17(21)8-13/h12-14,16-18,21H,4-11H2,1-3H3,(H,24,25)/t13?,14?,16?,17?,18-,21?/m0/s1