[2-phenyl-2-(4-pyridin-4-ylpiperazin-1-yl)ethanethioyl] ethanoate

Systemtic Name: [2-phenyl-2-(4-pyridin-4-ylpiperazin-1-yl)ethanethioyl] ethanoate Openeye Name: [2-phenyl-2-[4-(4-pyridyl)piperazin-1-yl]ethanethioyl] acetate CAS Name: acetic acid [2-phenyl-2-(4-pyridin-4-yl-1-piperazinyl)-1-sulfanylideneethyl] ester IUPAC Name: [2-phenyl-2-(4-pyridin-4-ylpiperazin-1-yl)ethanethioyl] acetate Traditional Name: acetic acid [2-phenyl-2-[4-(4-pyridyl)piperazino]thioacetyl] ester Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(=S)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CC(=O)OC(=S)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C19H21N3O2S/c1-15(23)24-19(25)18(16-5-3-2-4-6-16)22-13-11-21(12-14-22)17-7-9-20-10-8-17/h2-10,18H,11-14H2,1H3