1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-3-thiophen-3-yl-propan-1-one

Systemtic Name: 1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-3-thiophen-3-yl-propan-1-one Openeye Name: 1-[4-(4-pyridylmethyl)piperazin-1-yl]-3-(3-thienyl)propan-1-one CAS Name: 1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-3-(3-thiophenyl)-1-propanone IUPAC Name: 1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-3-thiophen-3-ylpropan-1-one Traditional Name: 1-[4-(4-pyridylmethyl)piperazino]-3-(3-thienyl)propan-1-one Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C(=O)CCC3=CSC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C(=O)CCC3=CSC=C3

InChI

InChI=1S/C17H21N3OS/c21-17(2-1-16-5-12-22-14-16)20-10-8-19(9-11-20)13-15-3-6-18-7-4-15/h3-7,12,14H,1-2,8-11,13H2