N-(5-bromanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-(5-bromanyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-(5-bromo-6-methyl-4-oxo-1H-pyrimidin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-(5-bromo-6-methyl-4-oxo-1H-pyrimidin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-(5-bromo-6-methyl-4-oxo-1H-pyrimidin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: N-(5-bromo-4-keto-6-methyl-1H-pyrimidin-2-yl)-4-keto-1H-quinazoline-2-carbothioamide Formula: C14H10BrN5O2S MolecularWeight: 392.2305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC(=S)C2=NC(=O)C3=CC=CC=C3N2)Br

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC(=S)C2=NC(=O)C3=CC=CC=C3N2)Br

InChI

InChI=1S/C14H10BrN5O2S/c1-6-9(15)12(22)19-14(16-6)20-13(23)10-17-8-5-3-2-4-7(8)11(21)18-10/h2-5H,1H3,(H,17,18,21)(H2,16,19,20,22,23)