(E)-3-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-bromo-2-fluoro-anilino)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-bromo-2-fluoroanilino)-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(4-bromo-2-fluoroanilino)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-bromo-2-fluoro-anilino)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C13H9BrFN3S MolecularWeight: 338.198063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CNC2=C(C=C(C=C2)Br)F)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/NC2=C(C=C(C=C2)Br)F)/C#N

InChI

InChI=1S/C13H9BrFN3S/c1-8-7-19-13(18-8)9(5-16)6-17-12-3-2-10(14)4-11(12)15/h2-4,6-7,17H,1H3/b9-6+