6-bromanyl-3-(4-propan-2-ylphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-(4-propan-2-ylphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-bromo-3-(4-isopropylbenzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-bromo-3-[oxo-(4-propan-2-ylphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-bromo-3-(4-propan-2-ylbenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-bromo-3-cumoyl-2-thioxo-1H-quinazolin-4-one Formula: C18H15BrN2O2S MolecularWeight: 403.2929

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2C(=O)C3=C(C=CC(=C3)Br)NC2=S

InChI

InChI=1S/C18H15BrN2O2S/c1-10(2)11-3-5-12(6-4-11)16(22)21-17(23)14-9-13(19)7-8-15(14)20-18(21)24/h3-10H,1-2H3,(H,20,24)