(E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC(=CS2)C)OCC

InChI

InChI=1S/C19H22N2O2S/c1-4-6-9-23-17-8-7-15(11-18(17)22-5-2)10-16(12-20)19-21-14(3)13-24-19/h7-8,10-11,13H,4-6,9H2,1-3H3/b16-10+