2-azanyl-4-methylsulfanyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile

Systemtic Name: 2-azanyl-4-methylsulfanyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Openeye Name: 2-amino-4-methylsulfanyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile CAS Name: 2-amino-4-(methylthio)-6-(3,4,5-trimethoxyphenyl)-5-pyrimidinecarbonitrile IUPAC Name: 2-amino-4-methylsulfanyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Traditional Name: 2-amino-4-(methylthio)-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carbonitrile Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)N)SC)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=C(C(=NC(=N2)N)SC)C#N

InChI

InChI=1S/C15H16N4O3S/c1-20-10-5-8(6-11(21-2)13(10)22-3)12-9(7-16)14(23-4)19-15(17)18-12/h5-6H,1-4H3,(H2,17,18,19)