N-(1-ethylsulfonylpiperidin-4-yl)-6-(3-methylphenyl)isoquinolin-8-amine

Systemtic Name: N-(1-ethylsulfonylpiperidin-4-yl)-6-(3-methylphenyl)isoquinolin-8-amine Openeye Name: N-(1-ethylsulfonyl-4-piperidyl)-6-(m-tolyl)isoquinolin-8-amine CAS Name: N-(1-ethylsulfonyl-4-piperidinyl)-6-(3-methylphenyl)-8-isoquinolinamine IUPAC Name: N-(1-ethylsulfonylpiperidin-4-yl)-6-(3-methylphenyl)isoquinolin-8-amine Traditional Name: (1-esyl-4-piperidyl)-[6-(m-tolyl)-8-isoquinolyl]amine Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)NC2=C3C=NC=CC3=CC(=C2)C4=CC(=CC=C4)C

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)NC2=C3C=NC=CC3=CC(=C2)C4=CC(=CC=C4)C

InChI

InChI=1S/C23H27N3O2S/c1-3-29(27,28)26-11-8-21(9-12-26)25-23-15-20(18-6-4-5-17(2)13-18)14-19-7-10-24-16-22(19)23/h4-7,10,13-16,21,25H,3,8-9,11-12H2,1-2H3