N-(3-methyl-1,2-thiazol-5-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide

Systemtic Name: N-(3-methyl-1,2-thiazol-5-yl)-4-oxidanylidene-1H-quinazoline-2-carbothioamide Openeye Name: N-(3-methylisothiazol-5-yl)-4-oxo-1H-quinazoline-2-carbothioamide CAS Name: N-(3-methyl-5-isothiazolyl)-4-oxo-1H-quinazoline-2-carbothioamide IUPAC Name: N-(3-methyl-1,2-thiazol-5-yl)-4-oxo-1H-quinazoline-2-carbothioamide Traditional Name: 4-keto-N-(3-methylisothiazol-5-yl)-1H-quinazoline-2-carbothioamide Formula: C13H10N4OS2 MolecularWeight: 302.3747

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N4OS2/c1-7-6-10(20-17-7)15-13(19)11-14-9-5-3-2-4-8(9)12(18)16-11/h2-6H,1H3,(H,15,19)(H,14,16,18)