3-[1-[(5-chloranylthiophen-2-yl)methyl]piperidin-4-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one

Systemtic Name: 3-[1-[(5-chloranylthiophen-2-yl)methyl]piperidin-4-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Openeye Name: 3-[1-[(5-chloro-2-thienyl)methyl]-4-piperidyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one CAS Name: 3-[1-[(5-chloro-2-thiophenyl)methyl]-4-piperidinyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)-1-propanone IUPAC Name: 3-[1-[(5-chlorothiophen-2-yl)methyl]piperidin-4-yl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Traditional Name: 3-[1-[(5-chloro-2-thienyl)methyl]-4-piperidyl]-1-(3,4-dihydro-1H-isoquinolin-2-yl)propan-1-one Formula: C22H27ClN2OS MolecularWeight: 402.98058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)N2CCC3=CC=CC=C3C2)CC4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCC1CCC(=O)N2CCC3=CC=CC=C3C2)CC4=CC=C(S4)Cl

InChI

InChI=1S/C22H27ClN2OS/c23-21-7-6-20(27-21)16-24-12-9-17(10-13-24)5-8-22(26)25-14-11-18-3-1-2-4-19(18)15-25/h1-4,6-7,17H,5,8-16H2