(E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[4-(cyanomethoxy)-3-methoxy-phenyl]-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CC2=CC(=C(C=C2)OCC#N)OC)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/C2=CC(=C(C=C2)OCC#N)OC)/C#N

InChI

InChI=1S/C16H13N3O2S/c1-11-10-22-16(19-11)13(9-18)7-12-3-4-14(21-6-5-17)15(8-12)20-2/h3-4,7-8,10H,6H2,1-2H3/b13-7+