N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-4,5-dihydrobenzo[g][1]benzothiole-2-carboxamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4,5-dihydrobenzo[g]benzothiophene-2-carboxamide Formula: C21H22N2OS2 MolecularWeight: 382.54218

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1=CC2=C(S1)C3=CC=CC=C3CC2)C4=CSC=C4

Isomeric SMILES

CN(C)C(CNC(=O)C1=CC2=C(S1)C3=CC=CC=C3CC2)C4=CSC=C4

InChI

InChI=1S/C21H22N2OS2/c1-23(2)18(16-9-10-25-13-16)12-22-21(24)19-11-15-8-7-14-5-3-4-6-17(14)20(15)26-19/h3-6,9-11,13,18H,7-8,12H2,1-2H3,(H,22,24)