5-[4-[3,5-bis(chloranyl)pyridin-4-yl]piperazin-1-yl]sulfonylisoquinoline

Systemtic Name: 5-[4-[3,5-bis(chloranyl)pyridin-4-yl]piperazin-1-yl]sulfonylisoquinoline Openeye Name: 5-[4-(3,5-dichloro-4-pyridyl)piperazin-1-yl]sulfonylisoquinoline CAS Name: 5-[[4-(3,5-dichloro-4-pyridinyl)-1-piperazinyl]sulfonyl]isoquinoline IUPAC Name: 5-[4-(3,5-dichloropyridin-4-yl)piperazin-1-yl]sulfonylisoquinoline Traditional Name: 5-[4-(3,5-dichloro-4-pyridyl)piperazino]sulfonylisoquinoline Formula: C18H16Cl2N4O2S MolecularWeight: 423.31624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=NC=C2Cl)Cl)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C18H16Cl2N4O2S/c19-15-11-22-12-16(20)18(15)23-6-8-24(9-7-23)27(25,26)17-3-1-2-13-10-21-5-4-14(13)17/h1-5,10-12H,6-9H2