2-[(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylmethyl]-6,8-bis(bromanyl)-1H-quinazolin-4-one

Systemtic Name: 2-[(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanylmethyl]-6,8-bis(bromanyl)-1H-quinazolin-4-one Openeye Name: 2-[(4-amino-6-methyl-pyrimidin-2-yl)sulfanylmethyl]-6,8-dibromo-1H-quinazolin-4-one CAS Name: 2-[[(4-amino-6-methyl-2-pyrimidinyl)thio]methyl]-6,8-dibromo-1H-quinazolin-4-one IUPAC Name: 2-[(4-amino-6-methylpyrimidin-2-yl)sulfanylmethyl]-6,8-dibromo-1H-quinazolin-4-one Traditional Name: 2-[[(4-amino-6-methyl-pyrimidin-2-yl)thio]methyl]-6,8-dibromo-1H-quinazolin-4-one Formula: C14H11Br2N5OS MolecularWeight: 457.14304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br)N

InChI

InChI=1S/C14H11Br2N5OS/c1-6-2-10(17)19-14(18-6)23-5-11-20-12-8(13(22)21-11)3-7(15)4-9(12)16/h2-4H,5H2,1H3,(H2,17,18,19)(H,20,21,22)