N-cyclopropyl-2-[4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)piperazin-1-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-(4,5-dihydrobenzo[g][1]benzothiol-2-ylcarbonyl)piperazin-1-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N-cyclopropyl-2-[4-[4,5-dihydrobenzo[g][1]benzothiol-2-yl(oxo)methyl]-1-piperazinyl]acetamide IUPAC Name: N-cyclopropyl-2-[4-(4,5-dihydrobenzo[g][1]benzothiole-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-(4,5-dihydrobenzo[g]benzothiophene-2-carbonyl)piperazino]acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2CCN(CC2)C(=O)C3=CC4=C(S3)C5=CC=CC=C5CC4

Isomeric SMILES

C1CC1NC(=O)CN2CCN(CC2)C(=O)C3=CC4=C(S3)C5=CC=CC=C5CC4

InChI

InChI=1S/C22H25N3O2S/c26-20(23-17-7-8-17)14-24-9-11-25(12-10-24)22(27)19-13-16-6-5-15-3-1-2-4-18(15)21(16)28-19/h1-4,13,17H,5-12,14H2,(H,23,26)