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

Systemtic Name: N-(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-(6-methyl-4-oxo-1H-pyrimidin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(4-keto-6-methyl-1H-pyrimidin-2-yl)-1H-quinazoline-2-carbothioamide Formula: C14H11N5O2S MolecularWeight: 313.33444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N5O2S/c1-7-6-10(20)17-14(15-7)19-13(22)11-16-9-5-3-2-4-8(9)12(21)18-11/h2-6H,1H3,(H,16,18,21)(H2,15,17,19,20,22)