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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(2,4-dichlorophenyl)ethanone Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(2,4-dichlorophenyl)ethanone CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-1-(2,4-dichlorophenyl)ethanone IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-1-(2,4-dichlorophenyl)ethanone Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-1-(2,4-dichlorophenyl)ethanone Formula: C12H10Cl2N4OS MolecularWeight: 329.205

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C12H10Cl2N4OS/c13-6-1-2-7(8(14)3-6)9(19)5-20-12-17-10(15)4-11(16)18-12/h1-4H,5H2,(H4,15,16,17,18)