2-azanyl-4-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-6-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-amino-4-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-6-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanyl-6-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 2-amino-4-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]-6-(methylthio)pyrimidine-5-carbonitrile Formula: C15H14N4O2S2 MolecularWeight: 346.42726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=NC(=NC(=C2C#N)SC)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=NC(=NC(=C2C#N)SC)N

InChI

InChI=1S/C15H14N4O2S2/c1-21-10-5-3-9(4-6-10)12(20)8-23-14-11(7-16)13(22-2)18-15(17)19-14/h3-6H,8H2,1-2H3,(H2,17,18,19)