4-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide

Systemtic Name: 4-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Openeye Name: 4-methylsulfonyl-N-[5-(1-piperidyl)-8-isoquinolyl]benzamide CAS Name: 4-methylsulfonyl-N-[5-(1-piperidinyl)-8-isoquinolinyl]benzamide IUPAC Name: 4-methylsulfonyl-N-(5-piperidin-1-ylisoquinolin-8-yl)benzamide Traditional Name: 4-mesyl-N-(5-piperidino-8-isoquinolyl)benzamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4

InChI

InChI=1S/C22H23N3O3S/c1-29(27,28)17-7-5-16(6-8-17)22(26)24-20-9-10-21(25-13-3-2-4-14-25)18-11-12-23-15-19(18)20/h5-12,15H,2-4,13-14H2,1H3,(H,24,26)