2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(3,4-dimethoxyphenyl)ethanone

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(3,4-dimethoxyphenyl)ethanone Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(3,4-dimethoxyphenyl)ethanone CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-1-(3,4-dimethoxyphenyl)ethanone IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(3,4-dimethoxyphenyl)ethanone Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-1-(3,4-dimethoxyphenyl)ethanone Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CSC2=NC(=CC(=N2)N)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CSC2=NC(=CC(=N2)N)N)OC

InChI

InChI=1S/C14H16N4O3S/c1-20-10-4-3-8(5-11(10)21-2)9(19)7-22-14-17-12(15)6-13(16)18-14/h3-6H,7H2,1-2H3,(H4,15,16,17,18)