1-(5-chloranyl-1-benzothiophen-2-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-(5-chloranyl-1-benzothiophen-2-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one Openeye Name: 3-(1-benzyl-4-piperidyl)-1-(5-chlorobenzothiophen-2-yl)propan-1-one CAS Name: 1-(5-chloro-1-benzothiophen-2-yl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone IUPAC Name: 3-(1-benzylpiperidin-4-yl)-1-(5-chloro-1-benzothiophen-2-yl)propan-1-one Traditional Name: 3-(1-benzyl-4-piperidyl)-1-(5-chlorobenzothiophen-2-yl)propan-1-one Formula: C23H24ClNOS MolecularWeight: 397.96076

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)C2=CC3=C(S2)C=CC(=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CCC(=O)C2=CC3=C(S2)C=CC(=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C23H24ClNOS/c24-20-7-9-22-19(14-20)15-23(27-22)21(26)8-6-17-10-12-25(13-11-17)16-18-4-2-1-3-5-18/h1-5,7,9,14-15,17H,6,8,10-13,16H2