3-(3,4-dichlorophenyl)-6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carbonitrile

Systemtic Name: 3-(3,4-dichlorophenyl)-6-methylsulfanyl-2,4-bis(oxidanylidene)-1H-pyrimidine-5-carbonitrile Openeye Name: 3-(3,4-dichlorophenyl)-6-methylsulfanyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile CAS Name: 3-(3,4-dichlorophenyl)-6-(methylthio)-2,4-dioxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 3-(3,4-dichlorophenyl)-6-methylsulfanyl-2,4-dioxo-1H-pyrimidine-5-carbonitrile Traditional Name: 3-(3,4-dichlorophenyl)-2,4-diketo-6-(methylthio)-1H-pyrimidine-5-carbonitrile Formula: C12H7Cl2N3O2S MolecularWeight: 328.17388

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)Cl)Cl)C#N

Isomeric SMILES

CSC1=C(C(=O)N(C(=O)N1)C2=CC(=C(C=C2)Cl)Cl)C#N

InChI

InChI=1S/C12H7Cl2N3O2S/c1-20-10-7(5-15)11(18)17(12(19)16-10)6-2-3-8(13)9(14)4-6/h2-4H,1H3,(H,16,19)