(6S)-2-(1-adamantylcarbonylamino)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: (6S)-2-(1-adamantylcarbonylamino)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-2-(adamantane-1-carbonylamino)-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-2-[[1-adamantyl(oxo)methyl]amino]-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-2-(adamantane-1-carbonylamino)-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-2-(adamantane-1-carbonylamino)-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)(C)[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H34N2O2S/c1-23(2,3)16-4-5-17-18(9-16)29-21(19(17)20(25)27)26-22(28)24-10-13-6-14(11-24)8-15(7-13)12-24/h13-16H,4-12H2,1-3H3,(H2,25,27)(H,26,28)/t13?,14?,15?,16-,24?/m0/s1