2-[(4-bromanylpiperidin-1-yl)methyl]-9-oxidanyl-4H-thieno[2,3-c]isoquinolin-5-one

Systemtic Name: 2-[(4-bromanylpiperidin-1-yl)methyl]-9-oxidanyl-4H-thieno[2,3-c]isoquinolin-5-one Openeye Name: 2-[(4-bromo-1-piperidyl)methyl]-9-hydroxy-4H-thieno[2,3-c]isoquinolin-5-one CAS Name: 2-[(4-bromo-1-piperidinyl)methyl]-9-hydroxy-4H-thieno[2,3-c]isoquinolin-5-one IUPAC Name: 2-[(4-bromopiperidin-1-yl)methyl]-9-hydroxy-4H-thieno[2,3-c]isoquinolin-5-one Traditional Name: 2-[(4-bromopiperidino)methyl]-9-hydroxy-4H-thien[2,3-c]isoquinolin-5-one Formula: C17H17BrN2O2S MolecularWeight: 393.29808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1Br)CC2=CC3=C(S2)NC(=O)C4=C3C(=CC=C4)O

Isomeric SMILES

C1CN(CCC1Br)CC2=CC3=C(S2)NC(=O)C4=C3C(=CC=C4)O

InChI

InChI=1S/C17H17BrN2O2S/c18-10-4-6-20(7-5-10)9-11-8-13-15-12(2-1-3-14(15)21)16(22)19-17(13)23-11/h1-3,8,10,21H,4-7,9H2,(H,19,22)