1-[(E)-[3-bromanyl-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-phenyl]methylideneamino]urea

Systemtic Name: 1-[(E)-[3-bromanyl-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-phenyl]methylideneamino]urea Openeye Name: [(E)-[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-phenyl]methyleneamino]urea CAS Name: [(E)-[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl]methylideneamino]urea IUPAC Name: [(E)-[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxyphenyl]methylideneamino]urea Traditional Name: [(E)-[3-bromo-4-[2-(4-tert-butylphenoxy)ethoxy]-5-methoxy-benzylidene]amino]urea Formula: C21H26BrN3O4 MolecularWeight: 464.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Br)C=NNC(=O)N)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCOC2=C(C=C(C=C2Br)/C=N/NC(=O)N)OC

InChI

InChI=1S/C21H26BrN3O4/c1-21(2,3)15-5-7-16(8-6-15)28-9-10-29-19-17(22)11-14(12-18(19)27-4)13-24-25-20(23)26/h5-8,11-13H,9-10H2,1-4H3,(H3,23,25,26)/b24-13+