4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)-N,N-diethyl-piperazine-1-carboxamide

Systemtic Name: 4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)-N,N-diethyl-piperazine-1-carboxamide Openeye Name: 4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)-N,N-diethyl-piperazine-1-carboxamide CAS Name: 4-[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]-N,N-diethyl-1-piperazinecarboxamide IUPAC Name: 4-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonyl)-N,N-diethylpiperazine-1-carboxamide Traditional Name: 4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)-N,N-diethyl-piperazine-1-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C22H27N3O2S/c1-3-23(4-2)22(27)25-13-11-24(12-14-25)21(26)19-15-17-10-9-16-7-5-6-8-18(16)20(17)28-19/h5-8,15H,3-4,9-14H2,1-2H3