4,5-dihydrobenzo[g][1]benzothiol-2-yl-(4-pyrrolidin-1-ylcarbonylpiperazin-1-yl)methanone

Systemtic Name: 4,5-dihydrobenzo[g][1]benzothiol-2-yl-(4-pyrrolidin-1-ylcarbonylpiperazin-1-yl)methanone Openeye Name: 4,5-dihydrobenzo[g]benzothiophen-2-yl-[4-(pyrrolidine-1-carbonyl)piperazin-1-yl]methanone CAS Name: 4,5-dihydrobenzo[g][1]benzothiol-2-yl-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperazinyl]methanone IUPAC Name: 4,5-dihydrobenzo[g][1]benzothiol-2-yl-[4-(pyrrolidine-1-carbonyl)piperazin-1-yl]methanone Traditional Name: 4,5-dihydrobenzo[g]benzothiophen-2-yl-[4-(pyrrolidine-1-carbonyl)piperazino]methanone Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(S3)C5=CC=CC=C5CC4

Isomeric SMILES

C1CCN(C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(S3)C5=CC=CC=C5CC4

InChI

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