(E)-3-(5-bromanyl-2-propoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(5-bromanyl-2-propoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(5-bromo-2-propoxy-phenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(5-bromo-2-propoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(5-bromo-2-propoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(5-bromo-2-propoxy-phenyl)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C16H15BrN2OS MolecularWeight: 363.2721

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C=C(C#N)C2=NC(=CS2)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)/C=C(\C#N)/C2=NC(=CS2)C

InChI

InChI=1S/C16H15BrN2OS/c1-3-6-20-15-5-4-14(17)8-12(15)7-13(9-18)16-19-11(2)10-21-16/h4-5,7-8,10H,3,6H2,1-2H3/b13-7+