2-[[2,5-dimethyl-4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[[2,5-dimethyl-4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[[2,5-dimethyl-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[[2,5-dimethyl-4-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]phenyl]methylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[[2,5-dimethyl-4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]phenyl]methylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[[4-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]-2,5-dimethyl-benzyl]thio]-6-methyl-1H-pyrimidin-4-one Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NC(=O)C=C(N2)C)C)CSC3=NC(=O)C=C(N3)C

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NC(=O)C=C(N2)C)C)CSC3=NC(=O)C=C(N3)C

InChI

InChI=1S/C20H22N4O2S2/c1-11-5-16(10-28-20-22-14(4)8-18(26)24-20)12(2)6-15(11)9-27-19-21-13(3)7-17(25)23-19/h5-8H,9-10H2,1-4H3,(H,21,23,25)(H,22,24,26)