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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-(4-cyclohexylphenyl)ethanone Openeye Name: 1-(4-cyclohexylphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-(4-cyclohexylphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-(4-cyclohexylphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanylethanone Traditional Name: 1-(4-cyclohexylphenyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]ethanone Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C18H22N4OS/c19-16-10-17(20)22-18(21-16)24-11-15(23)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h6-10,12H,1-5,11H2,(H4,19,20,21,22)