1-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-3-pyridin-3-yl-propan-1-one

Systemtic Name: 1-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-3-pyridin-3-yl-propan-1-one Openeye Name: 1-[4-[[5-(3-chlorophenyl)-2-thienyl]methyl]piperazin-1-yl]-3-(3-pyridyl)propan-1-one CAS Name: 1-[4-[[5-(3-chlorophenyl)-2-thiophenyl]methyl]-1-piperazinyl]-3-(3-pyridinyl)-1-propanone IUPAC Name: 1-[4-[[5-(3-chlorophenyl)thiophen-2-yl]methyl]piperazin-1-yl]-3-pyridin-3-ylpropan-1-one Traditional Name: 1-[4-[[5-(3-chlorophenyl)-2-thienyl]methyl]piperazino]-3-(3-pyridyl)propan-1-one Formula: C23H24ClN3OS MolecularWeight: 425.97416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)Cl)C(=O)CCC4=CN=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)C3=CC(=CC=C3)Cl)C(=O)CCC4=CN=CC=C4

InChI

InChI=1S/C23H24ClN3OS/c24-20-5-1-4-19(15-20)22-8-7-21(29-22)17-26-11-13-27(14-12-26)23(28)9-6-18-3-2-10-25-16-18/h1-5,7-8,10,15-16H,6,9,11-14,17H2