5-(3-methylpiperazin-1-yl)sulfonylisoquinoline dihydrochloride

Systemtic Name: 5-(3-methylpiperazin-1-yl)sulfonylisoquinoline dihydrochloride Openeye Name: 5-(3-methylpiperazin-1-yl)sulfonylisoquinoline dihydrochloride CAS Name: 5-[(3-methyl-1-piperazinyl)sulfonyl]isoquinoline dihydrochloride IUPAC Name: 5-(3-methylpiperazin-1-yl)sulfonylisoquinoline dihydrochloride Traditional Name: 5-(3-methylpiperazino)sulfonylisoquinoline dihydrochloride Formula: C14H19Cl2N3O2S MolecularWeight: 364.29056

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl.Cl

Isomeric SMILES

CC1CN(CCN1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3.Cl.Cl

InChI

InChI=1S/C14H17N3O2S.2ClH/c1-11-10-17(8-7-16-11)20(18,19)14-4-2-3-12-9-15-6-5-13(12)14;;/h2-6,9,11,16H,7-8,10H2,1H3;2*1H