2-[6-bromanyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-bis(2-methylpropyl)ethanamide

Systemtic Name: 2-[6-bromanyl-3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-bis(2-methylpropyl)ethanamide Openeye Name: 2-[6-bromo-3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-N,N-diisobutyl-acetamide CAS Name: 2-[[6-bromo-3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N,N-bis(2-methylpropyl)acetamide IUPAC Name: 2-[6-bromo-3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N,N-bis(2-methylpropyl)acetamide Traditional Name: 2-[[6-bromo-4-keto-3-(o-tolyl)quinazolin-2-yl]thio]-N,N-diisobutyl-acetamide Formula: C25H30BrN3O2S MolecularWeight: 516.4936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC(=O)N(CC(C)C)CC(C)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC(=O)N(CC(C)C)CC(C)C

InChI

InChI=1S/C25H30BrN3O2S/c1-16(2)13-28(14-17(3)4)23(30)15-32-25-27-21-11-10-19(26)12-20(21)24(31)29(25)22-9-7-6-8-18(22)5/h6-12,16-17H,13-15H2,1-5H3