2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide

Systemtic Name: 2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-(6-bromo-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[[6-bromo-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-[6-bromo-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(6-bromo-3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-m-anisyl-acetamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H24BrN3O3S/c1-14(2)12-26-21(28)18-10-16(23)7-8-19(18)25-22(26)30-13-20(27)24-11-15-5-4-6-17(9-15)29-3/h4-10,14H,11-13H2,1-3H3,(H,24,27)