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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-1-[4-(4-bromophenyl)phenyl]ethanone Openeye Name: 1-[4-(4-bromophenyl)phenyl]-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-ethanone CAS Name: 1-[4-(4-bromophenyl)phenyl]-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone IUPAC Name: 1-[4-(4-bromophenyl)phenyl]-2-(4,6-diaminopyrimidin-2-yl)sulfanylethanone Traditional Name: 1-[4-(4-bromophenyl)phenyl]-2-[(4,6-diaminopyrimidin-2-yl)thio]ethanone Formula: C18H15BrN4OS MolecularWeight: 415.3069

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)Br)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)Br)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C18H15BrN4OS/c19-14-7-5-12(6-8-14)11-1-3-13(4-2-11)15(24)10-25-18-22-16(20)9-17(21)23-18/h1-9H,10H2,(H4,20,21,22,23)