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

Systemtic Name: 6-bromanyl-N-butan-2-yl-3-(4-ethylphenyl)-4-oxidanyl-2-oxidanylidene-1H-quinazoline-4-carboxamide Openeye Name: 6-bromo-3-(4-ethylphenyl)-4-hydroxy-2-oxo-N-sec-butyl-1H-quinazoline-4-carboxamide CAS Name: 6-bromo-N-butan-2-yl-3-(4-ethylphenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide IUPAC Name: 6-bromo-N-butan-2-yl-3-(4-ethylphenyl)-4-hydroxy-2-oxo-1H-quinazoline-4-carboxamide Traditional Name: 6-bromo-3-(4-ethylphenyl)-4-hydroxy-2-keto-N-sec-butyl-1H-quinazoline-4-carboxamide Formula: C21H24BrN3O3 MolecularWeight: 446.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)NC3=C(C2(C(=O)NC(C)CC)O)C=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)NC3=C(C2(C(=O)NC(C)CC)O)C=C(C=C3)Br

InChI

InChI=1S/C21H24BrN3O3/c1-4-13(3)23-19(26)21(28)17-12-15(22)8-11-18(17)24-20(27)25(21)16-9-6-14(5-2)7-10-16/h6-13,28H,4-5H2,1-3H3,(H,23,26)(H,24,27)