3-[(2-bromanyl-4-butan-2-yloxy-5-ethoxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[(2-bromanyl-4-butan-2-yloxy-5-ethoxy-phenyl)methylideneamino]-1H-quinazoline-2,4-dione Openeye Name: 3-[(2-bromo-5-ethoxy-4-sec-butoxy-phenyl)methyleneamino]-1H-quinazoline-2,4-dione CAS Name: 3-[(2-bromo-4-butan-2-yloxy-5-ethoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione IUPAC Name: 3-[(2-bromo-4-butan-2-yloxy-5-ethoxyphenyl)methylideneamino]-1H-quinazoline-2,4-dione Traditional Name: 3-[(2-bromo-5-ethoxy-4-sec-butoxy-benzylidene)amino]-1H-quinazoline-2,4-quinone Formula: C21H22BrN3O4 MolecularWeight: 460.32108

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C(=C1)Br)C=NN2C(=O)C3=CC=CC=C3NC2=O)OCC

Isomeric SMILES

CCC(C)OC1=C(C=C(C(=C1)Br)C=NN2C(=O)C3=CC=CC=C3NC2=O)OCC

InChI

InChI=1S/C21H22BrN3O4/c1-4-13(3)29-19-11-16(22)14(10-18(19)28-5-2)12-23-25-20(26)15-8-6-7-9-17(15)24-21(25)27/h6-13H,4-5H2,1-3H3,(H,24,27)