[3-bromanyl-4-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]phenyl] thiocyanate

Systemtic Name: [3-bromanyl-4-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]phenyl] thiocyanate Openeye Name: [3-bromo-4-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]phenyl] thiocyanate CAS Name: thiocyanic acid [3-bromo-4-[[(E)-2-cyano-2-(4-methyl-2-thiazolyl)ethenyl]amino]phenyl] ester IUPAC Name: [3-bromo-4-[[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]amino]phenyl] thiocyanate Traditional Name: thiocyanic acid [3-bromo-4-[[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]amino]phenyl] ester Formula: C14H9BrN4S2 MolecularWeight: 377.28206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9BrN4S2/c1-9-7-20-14(19-9)10(5-16)6-18-13-3-2-11(21-8-17)4-12(13)15/h2-4,6-7,18H,1H3/b10-6+