4-[[4-[2-[1-(2-thiophen-3-ylethanoyl)piperidin-2-yl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[[4-[2-[1-(2-thiophen-3-ylethanoyl)piperidin-2-yl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde Openeye Name: 4-[[4-[2-[1-[2-(3-thienyl)acetyl]-2-piperidyl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-[2-[1-[1-oxo-2-(3-thiophenyl)ethyl]-2-piperidinyl]ethoxy]phenyl]methyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[[4-[2-[1-(2-thiophen-3-ylacetyl)piperidin-2-yl]ethoxy]phenyl]methyl]piperazine-1-carbaldehyde Traditional Name: 4-[4-[2-[1-[2-(3-thienyl)acetyl]-2-piperidyl]ethoxy]benzyl]piperazine-1-carbaldehyde Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CCOC2=CC=C(C=C2)CN3CCN(CC3)C=O)C(=O)CC4=CSC=C4

Isomeric SMILES

C1CCN(C(C1)CCOC2=CC=C(C=C2)CN3CCN(CC3)C=O)C(=O)CC4=CSC=C4

InChI

InChI=1S/C25H33N3O3S/c29-20-27-13-11-26(12-14-27)18-21-4-6-24(7-5-21)31-15-8-23-3-1-2-10-28(23)25(30)17-22-9-16-32-19-22/h4-7,9,16,19-20,23H,1-3,8,10-15,17-18H2