3-[(2-aminophenyl)amino]-2-[(5-bromanyl-2-phenylmethoxy-phenyl)methylidene]but-3-enenitrile

Systemtic Name: 3-[(2-aminophenyl)amino]-2-[(5-bromanyl-2-phenylmethoxy-phenyl)methylidene]but-3-enenitrile Openeye Name: 3-(2-aminoanilino)-2-[(2-benzyloxy-5-bromo-phenyl)methylene]but-3-enenitrile CAS Name: 3-(2-aminoanilino)-2-[(5-bromo-2-phenylmethoxyphenyl)methylidene]-3-butenenitrile IUPAC Name: 3-(2-aminoanilino)-2-[(5-bromo-2-phenylmethoxyphenyl)methylidene]but-3-enenitrile Traditional Name: 3-(2-aminoanilino)-2-(2-benzoxy-5-bromo-benzylidene)but-3-enenitrile Formula: C24H20BrN3O MolecularWeight: 446.3391

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C#N)NC3=CC=CC=C3N

Isomeric SMILES

C=C(C(=CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C#N)NC3=CC=CC=C3N

InChI

InChI=1S/C24H20BrN3O/c1-17(28-23-10-6-5-9-22(23)27)20(15-26)13-19-14-21(25)11-12-24(19)29-16-18-7-3-2-4-8-18/h2-14,28H,1,16,27H2