(4-isoquinolin-5-ylsulfonylpiperazin-1-yl)-phenyl-methanone

Systemtic Name: (4-isoquinolin-5-ylsulfonylpiperazin-1-yl)-phenyl-methanone Openeye Name: [4-(5-isoquinolylsulfonyl)piperazin-1-yl]-phenyl-methanone CAS Name: [4-(5-isoquinolinylsulfonyl)-1-piperazinyl]-phenylmethanone IUPAC Name: (4-isoquinolin-5-ylsulfonylpiperazin-1-yl)-phenylmethanone Traditional Name: [4-(5-isoquinolylsulfonyl)piperazino]-phenyl-methanone Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C20H19N3O3S/c24-20(16-5-2-1-3-6-16)22-11-13-23(14-12-22)27(25,26)19-8-4-7-17-15-21-10-9-18(17)19/h1-10,15H,11-14H2