N-[1-cyclopentyl-2-[(7-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-N-oxidanyl-methanamide

Systemtic Name: N-[1-cyclopentyl-2-[(7-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-N-oxidanyl-methanamide Openeye Name: N-[1-cyclopentyl-2-[[7-(4-pyridyl)-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]ethyl]-N-hydroxy-formamide CAS Name: N-[1-cyclopentyl-2-[(7-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-N-hydroxyformamide IUPAC Name: N-[1-cyclopentyl-2-[(7-pyridin-4-yl-3,4-dihydro-1H-isoquinolin-2-yl)sulfonyl]ethyl]-N-hydroxyformamide Traditional Name: N-[1-cyclopentyl-2-[[7-(4-pyridyl)-3,4-dihydro-1H-isoquinolin-2-yl]sulfonyl]ethyl]-N-hydroxy-formamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(CS(=O)(=O)N2CCC3=C(C2)C=C(C=C3)C4=CC=NC=C4)N(C=O)O

Isomeric SMILES

C1CCC(C1)C(CS(=O)(=O)N2CCC3=C(C2)C=C(C=C3)C4=CC=NC=C4)N(C=O)O

InChI

InChI=1S/C22H27N3O4S/c26-16-25(27)22(19-3-1-2-4-19)15-30(28,29)24-12-9-17-5-6-20(13-21(17)14-24)18-7-10-23-11-8-18/h5-8,10-11,13,16,19,22,27H,1-4,9,12,14-15H2