N-[2-[(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)methyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: N-[2-[(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)methyl]-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: N-[2-[(4-bromo-2-isopropyl-5-methyl-phenoxy)methyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: N-[2-[(4-bromo-5-methyl-2-propan-2-ylphenoxy)methyl]-4-oxo-3-quinazolinyl]acetamide IUPAC Name: N-[2-[(4-bromo-5-methyl-2-propan-2-ylphenoxy)methyl]-4-oxoquinazolin-3-yl]acetamide Traditional Name: N-[2-[(4-bromo-2-isopropyl-5-methyl-phenoxy)methyl]-4-keto-quinazolin-3-yl]acetamide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC2=NC3=CC=CC=C3C(=O)N2NC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC2=NC3=CC=CC=C3C(=O)N2NC(=O)C

InChI

InChI=1S/C21H22BrN3O3/c1-12(2)16-10-17(22)13(3)9-19(16)28-11-20-23-18-8-6-5-7-15(18)21(27)25(20)24-14(4)26/h5-10,12H,11H2,1-4H3,(H,24,26)