4-chloranyl-6-[(3,4-dimethoxyphenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 4-chloranyl-6-[(3,4-dimethoxyphenyl)amino]-2-methylsulfanyl-pyrimidine-5-carbonitrile Openeye Name: 4-chloro-6-(3,4-dimethoxyanilino)-2-methylsulfanyl-pyrimidine-5-carbonitrile CAS Name: 4-chloro-6-(3,4-dimethoxyanilino)-2-(methylthio)-5-pyrimidinecarbonitrile IUPAC Name: 4-chloro-6-(3,4-dimethoxyanilino)-2-methylsulfanylpyrimidine-5-carbonitrile Traditional Name: 4-chloro-6-(3,4-dimethoxyanilino)-2-(methylthio)pyrimidine-5-carbonitrile Formula: C14H13ClN4O2S MolecularWeight: 336.79662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C(C(=NC(=N2)SC)Cl)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C(C(=NC(=N2)SC)Cl)C#N)OC

InChI

InChI=1S/C14H13ClN4O2S/c1-20-10-5-4-8(6-11(10)21-2)17-13-9(7-16)12(15)18-14(19-13)22-3/h4-6H,1-3H3,(H,17,18,19)