3-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)propanamide

Systemtic Name: 3-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)propanamide Openeye Name: 3-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-phenylethyl)propanamide CAS Name: 3-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-(1-phenylethyl)propanamide IUPAC Name: 3-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1-phenylethyl)propanamide Traditional Name: 3-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-(1-phenylethyl)propionamide Formula: C22H24BrN3O3S MolecularWeight: 490.41326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CCSC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)CCSC2=NC3=C(C=C(C=C3)Br)C(=O)N2CCOC

InChI

InChI=1S/C22H24BrN3O3S/c1-15(16-6-4-3-5-7-16)24-20(27)10-13-30-22-25-19-9-8-17(23)14-18(19)21(28)26(22)11-12-29-2/h3-9,14-15H,10-13H2,1-2H3,(H,24,27)