N-[4-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[4-(4-prop-2-ynyl-1-piperazinyl)phenyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[4-(4-prop-2-ynylpiperazin-1-yl)phenyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[4-(4-propargylpiperazino)phenyl]-2-(2-pyridylthio)acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=N3

Isomeric SMILES

C#CCN1CCN(CC1)C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C20H22N4OS/c1-2-11-23-12-14-24(15-13-23)18-8-6-17(7-9-18)22-19(25)16-26-20-5-3-4-10-21-20/h1,3-10H,11-16H2,(H,22,25)