6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one

Systemtic Name: 6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one Openeye Name: 6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one CAS Name: 6-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-2-(4-phenyl-1-piperazinyl)-1H-pyrimidin-4-one IUPAC Name: 6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-2-(4-phenylpiperazin-1-yl)-1H-pyrimidin-4-one Traditional Name: 6-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-2-(4-phenylpiperazino)-1H-pyrimidin-4-one Formula: C18H20N6OS2 MolecularWeight: 400.521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC2=CC(=O)N=C(N2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN=C(S1)SCC2=CC(=O)N=C(N2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C18H20N6OS2/c1-13-21-22-18(27-13)26-12-14-11-16(25)20-17(19-14)24-9-7-23(8-10-24)15-5-3-2-4-6-15/h2-6,11H,7-10,12H2,1H3,(H,19,20,25)