3-(4,6-dimethyl-2-sulfanylidene-1H-pyrimidin-5-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(4,6-dimethyl-2-sulfanylidene-1H-pyrimidin-5-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(4,6-dimethyl-2-thioxo-1H-pyrimidin-5-yl)-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4,6-dimethyl-2-sulfanylidene-1H-pyrimidin-5-yl)-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4,6-dimethyl-2-sulfanylidene-1H-pyrimidin-5-yl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(4,6-dimethyl-2-thioxo-1H-pyrimidin-5-yl)-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=S)N1)C)CCC(=O)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC1=C(C(=NC(=S)N1)C)CCC(=O)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C18H23N5OS/c1-13-15(14(2)21-18(25)20-13)6-7-17(24)23-11-9-22(10-12-23)16-5-3-4-8-19-16/h3-5,8H,6-7,9-12H2,1-2H3,(H,20,21,25)