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

Systemtic Name: (6S)-2-(1-adamantylcarbonylamino)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: (6S)-2-(adamantane-1-carbonylamino)-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: (6S)-2-[[1-adamantyl(oxo)methyl]amino]-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: (6S)-2-(adamantane-1-carbonylamino)-6-propyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: (6S)-2-(adamantane-1-carbonylamino)-6-propyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H32N2O2S MolecularWeight: 400.57738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O2S/c1-2-3-13-4-5-17-18(9-13)28-21(19(17)20(24)26)25-22(27)23-10-14-6-15(11-23)8-16(7-14)12-23/h13-16H,2-12H2,1H3,(H2,24,26)(H,25,27)/t13-,14?,15?,16?,23?/m0/s1