5-[(2-methylpiperazin-1-yl)methylsulfonyl]isoquinoline

Systemtic Name: 5-[(2-methylpiperazin-1-yl)methylsulfonyl]isoquinoline Openeye Name: 5-[(2-methylpiperazin-1-yl)methylsulfonyl]isoquinoline CAS Name: 5-[(2-methyl-1-piperazinyl)methylsulfonyl]isoquinoline IUPAC Name: 5-[(2-methylpiperazin-1-yl)methylsulfonyl]isoquinoline Traditional Name: 5-[(2-methylpiperazino)methylsulfonyl]isoquinoline Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCN1CS(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CC1CNCCN1CS(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C15H19N3O2S/c1-12-9-17-7-8-18(12)11-21(19,20)15-4-2-3-13-10-16-6-5-14(13)15/h2-6,10,12,17H,7-9,11H2,1H3