2-[3-(4-isoquinolin-1-ylpiperazin-1-yl)propyl]-3H-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 2-[3-(4-isoquinolin-1-ylpiperazin-1-yl)propyl]-3H-1,2-benzothiazole 1,1-dioxide Openeye Name: 2-[3-[4-(1-isoquinolyl)piperazin-1-yl]propyl]-3H-1,2-benzothiazole 1,1-dioxide CAS Name: 2-[3-[4-(1-isoquinolinyl)-1-piperazinyl]propyl]-3H-1,2-benzothiazole 1,1-dioxide IUPAC Name: 2-[3-(4-isoquinolin-1-ylpiperazin-1-yl)propyl]-3H-1,2-benzothiazole 1,1-dioxide Traditional Name: 2-[3-[4-(1-isoquinolyl)piperazino]propyl]-3H-1,2-benzothiazole 1,1-dioxide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2CC3=CC=CC=C3S2(=O)=O)C4=NC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1CCCN2CC3=CC=CC=C3S2(=O)=O)C4=NC=CC5=CC=CC=C54

InChI

InChI=1S/C23H26N4O2S/c28-30(29)22-9-4-2-7-20(22)18-27(30)13-5-12-25-14-16-26(17-15-25)23-21-8-3-1-6-19(21)10-11-24-23/h1-4,6-11H,5,12-18H2