1-chloranyl-5-piperazin-1-ylsulfonyl-isoquinoline

Systemtic Name: 1-chloranyl-5-piperazin-1-ylsulfonyl-isoquinoline Openeye Name: 1-chloro-5-piperazin-1-ylsulfonyl-isoquinoline CAS Name: 1-chloro-5-(1-piperazinylsulfonyl)isoquinoline IUPAC Name: 1-chloro-5-piperazin-1-ylsulfonylisoquinoline Traditional Name: 1-chloro-5-piperazinosulfonyl-isoquinoline Formula: C13H14ClN3O2S MolecularWeight: 311.78716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3Cl

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3Cl

InChI

InChI=1S/C13H14ClN3O2S/c14-13-11-2-1-3-12(10(11)4-5-16-13)20(18,19)17-8-6-15-7-9-17/h1-5,15H,6-9H2