3-(1-benzothiophen-4-yl)-1-(1-phenyl-2-pyrrolidin-1-yl-ethyl)piperidin-2-one

Systemtic Name: 3-(1-benzothiophen-4-yl)-1-(1-phenyl-2-pyrrolidin-1-yl-ethyl)piperidin-2-one Openeye Name: 3-(benzothiophen-4-yl)-1-(1-phenyl-2-pyrrolidin-1-yl-ethyl)piperidin-2-one CAS Name: 3-(1-benzothiophen-4-yl)-1-[1-phenyl-2-(1-pyrrolidinyl)ethyl]-2-piperidinone IUPAC Name: 3-(1-benzothiophen-4-yl)-1-(1-phenyl-2-pyrrolidin-1-ylethyl)piperidin-2-one Traditional Name: 3-(benzothiophen-4-yl)-1-(1-phenyl-2-pyrrolidino-ethyl)-2-piperidone Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC(C2=CC=CC=C2)N3CCCC(C3=O)C4=C5C=CSC5=CC=C4

Isomeric SMILES

C1CCN(C1)CC(C2=CC=CC=C2)N3CCCC(C3=O)C4=C5C=CSC5=CC=C4

InChI

InChI=1S/C25H28N2OS/c28-25-22(20-10-6-12-24-21(20)13-17-29-24)11-7-16-27(25)23(18-26-14-4-5-15-26)19-8-2-1-3-9-19/h1-3,6,8-10,12-13,17,22-23H,4-5,7,11,14-16,18H2