ethyl 4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonylamino)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonylamino)piperidine-1-carboxylate Openeye Name: ethyl 4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonylamino)piperidine-1-carboxylate CAS Name: 4-[[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonylamino)piperidine-1-carboxylate Traditional Name: 4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonylamino)piperidine-1-carboxylic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC3=C(S2)C4=CC=CC=C4CC3

InChI

InChI=1S/C21H24N2O3S/c1-2-26-21(25)23-11-9-16(10-12-23)22-20(24)18-13-15-8-7-14-5-3-4-6-17(14)19(15)27-18/h3-6,13,16H,2,7-12H2,1H3,(H,22,24)