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

Systemtic Name: 2-[6-bromanyl-3-[(2-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-cyclohexyl-ethanamide Openeye Name: 2-[6-bromo-3-[(2-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N-cyclohexyl-acetamide CAS Name: 2-[[6-bromo-3-[(2-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[6-bromo-3-[(2-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N-cyclohexylacetamide Traditional Name: 2-[(6-bromo-4-keto-3-o-anisyl-quinazolin-2-yl)thio]-N-cyclohexyl-acetamide Formula: C24H26BrN3O3S MolecularWeight: 516.45054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC(=O)NC4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1CN2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC(=O)NC4CCCCC4

InChI

InChI=1S/C24H26BrN3O3S/c1-31-21-10-6-5-7-16(21)14-28-23(30)19-13-17(25)11-12-20(19)27-24(28)32-15-22(29)26-18-8-3-2-4-9-18/h5-7,10-13,18H,2-4,8-9,14-15H2,1H3,(H,26,29)