N-(1-adamantyl)-N-ethyl-7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-(1-adamantyl)-N-ethyl-7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-(1-adamantyl)-N-ethyl-7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-(1-adamantyl)-N-ethyl-7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-(1-adamantyl)-N-ethyl-7-methoxy-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-(1-adamantyl)-N-ethyl-7-methoxy-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C26H31NO2S MolecularWeight: 421.59484

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC2=C(S1)C3=C(CC2)C=C(C=C3)OC)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCN(C(=O)C1=CC2=C(S1)C3=C(CC2)C=C(C=C3)OC)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H31NO2S/c1-3-27(26-13-16-8-17(14-26)10-18(9-16)15-26)25(28)23-12-20-5-4-19-11-21(29-2)6-7-22(19)24(20)30-23/h6-7,11-12,16-18H,3-5,8-10,13-15H2,1-2H3