5-[4-(3-methylphenyl)piperazin-1-yl]sulfonylisoquinoline

Systemtic Name: 5-[4-(3-methylphenyl)piperazin-1-yl]sulfonylisoquinoline Openeye Name: 5-[4-(m-tolyl)piperazin-1-yl]sulfonylisoquinoline CAS Name: 5-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]isoquinoline IUPAC Name: 5-[4-(3-methylphenyl)piperazin-1-yl]sulfonylisoquinoline Traditional Name: 5-[4-(m-tolyl)piperazino]sulfonylisoquinoline Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C20H21N3O2S/c1-16-4-2-6-18(14-16)22-10-12-23(13-11-22)26(24,25)20-7-3-5-17-15-21-9-8-19(17)20/h2-9,14-15H,10-13H2,1H3