N-(5-methylpyridin-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-(5-methylpyridin-2-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-(5-methyl-2-pyridyl)-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-(5-methyl-2-pyridinyl)-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-(5-methylpyridin-2-yl)-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(5-methyl-2-pyridyl)-1H-quinazoline-2-carbothioamide Formula: C15H12N4OS MolecularWeight: 296.34698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC(=S)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CN=C(C=C1)NC(=S)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C15H12N4OS/c1-9-6-7-12(16-8-9)18-15(21)13-17-11-5-3-2-4-10(11)14(20)19-13/h2-8H,1H3,(H,16,18,21)(H,17,19,20)