(6E)-2-bromanyl-4-methyl-6-[[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-2-bromanyl-4-methyl-6-[[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-bromo-4-methyl-6-[[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-2-bromo-4-methyl-6-[[[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2-bromo-4-methyl-6-[[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-bromo-4-methyl-6-[[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C20H14BrN3O2 MolecularWeight: 408.24806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CN=CC=C4)C(=O)C(=C1)Br

Isomeric SMILES

CC1=C/C(=C\NC2=CC3=C(C=C2)OC(=N3)C4=CN=CC=C4)/C(=O)C(=C1)Br

InChI

InChI=1S/C20H14BrN3O2/c1-12-7-14(19(25)16(21)8-12)11-23-15-4-5-18-17(9-15)24-20(26-18)13-3-2-6-22-10-13/h2-11,23H,1H3/b14-11+