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

Systemtic Name: 2-bromanyl-3,4-dimethyl-6-[[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 2-bromo-3,4-dimethyl-6-[[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-bromo-3,4-dimethyl-6-[[[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 2-bromo-3,4-dimethyl-6-[[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 2-bromo-3,4-dimethyl-6-[[[2-(3-pyridyl)-1,3-benzoxazol-5-yl]amino]methylene]cyclohexa-2,4-dien-1-one Formula: C21H16BrN3O2 MolecularWeight: 422.27464

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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(=C1C)Br

Isomeric SMILES

CC1=CC(=CNC2=CC3=C(C=C2)OC(=N3)C4=CN=CC=C4)C(=O)C(=C1C)Br

InChI

InChI=1S/C21H16BrN3O2/c1-12-8-15(20(26)19(22)13(12)2)11-24-16-5-6-18-17(9-16)25-21(27-18)14-4-3-7-23-10-14/h3-11,24H,1-2H3