N-(4-bromanyl-2,6-dimethyl-phenyl)-N'-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanediamide

Systemtic Name: N-(4-bromanyl-2,6-dimethyl-phenyl)-N'-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethanediamide Openeye Name: N-(4-bromo-2,6-dimethyl-phenyl)-N'-(4-oxo-2-thioxo-1H-quinazolin-3-yl)oxamide CAS Name: N-(4-bromo-2,6-dimethylphenyl)-N'-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)oxamide IUPAC Name: N-(4-bromo-2,6-dimethylphenyl)-N'-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)oxamide Traditional Name: N-(4-bromo-2,6-dimethyl-phenyl)-N'-(4-keto-2-thioxo-1H-quinazolin-3-yl)oxamide Formula: C18H15BrN4O3S MolecularWeight: 447.3057

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C(=O)NN2C(=O)C3=CC=CC=C3NC2=S)C)Br

InChI

InChI=1S/C18H15BrN4O3S/c1-9-7-11(19)8-10(2)14(9)21-15(24)16(25)22-23-17(26)12-5-3-4-6-13(12)20-18(23)27/h3-8H,1-2H3,(H,20,27)(H,21,24)(H,22,25)