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

Systemtic Name: 2-(4-methylpiperazin-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)-sulfanyl-methyl]-1H-pyrimidin-4-one Openeye Name: 2-(4-methylpiperazin-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)-sulfanyl-methyl]-1H-pyrimidin-4-one CAS Name: 6-[mercapto-(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-2-(4-methyl-1-piperazinyl)-1H-pyrimidin-4-one IUPAC Name: 2-(4-methylpiperazin-1-yl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)-sulfanylmethyl]-1H-pyrimidin-4-one Traditional Name: 6-[mercapto-(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-2-(4-methylpiperazino)-1H-pyrimidin-4-one Formula: C13H18N6OS2 MolecularWeight: 338.45162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)C(C2=CC(=O)N=C(N2)N3CCN(CC3)C)S

Isomeric SMILES

CC1=NN=C(S1)C(C2=CC(=O)N=C(N2)N3CCN(CC3)C)S

InChI

InChI=1S/C13H18N6OS2/c1-8-16-17-12(22-8)11(21)9-7-10(20)15-13(14-9)19-5-3-18(2)4-6-19/h7,11,21H,3-6H2,1-2H3,(H,14,15,20)