6-bromanyl-N-butan-2-yl-3-(4-ethoxyphenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-butan-2-yl-3-(4-ethoxyphenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 6-bromo-3-(4-ethoxyphenyl)-4-hydroxy-2-oxo-N-sec-butyl-1H-quinazoline-4-carboxamide CAS Name: 6-bromo-N-butan-2-yl-3-(4-ethoxyphenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 6-bromo-N-butan-2-yl-3-(4-ethoxyphenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 6-bromo-4-hydroxy-2-keto-3-p-phenetyl-N-sec-butyl-1H-quinazoline-4-carboxamide Formula: C21H24BrN3O4 MolecularWeight: 462.33696

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1(C2=C(C=CC(=C2)Br)NC(=O)N1C3=CC=C(C=C3)OCC)O

Isomeric SMILES

CCC(C)NC(=O)C1(C2=C(C=CC(=C2)Br)NC(=O)N1C3=CC=C(C=C3)OCC)O

InChI

InChI=1S/C21H24BrN3O4/c1-4-13(3)23-19(26)21(28)17-12-14(22)6-11-18(17)24-20(27)25(21)15-7-9-16(10-8-15)29-5-2/h6-13,28H,4-5H2,1-3H3,(H,23,26)(H,24,27)