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

Systemtic Name: (E)-3-(4-methoxy-3-phenylmethoxy-phenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(3-benzyloxy-4-methoxy-phenyl)-2-(4-methylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-methoxy-3-phenylmethoxyphenyl)-2-(4-methyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(4-methoxy-3-phenylmethoxyphenyl)-2-(4-methyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(3-benzoxy-4-methoxy-phenyl)-2-(4-methylthiazol-2-yl)acrylonitrile Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(=CC2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CSC(=N1)/C(=C/C2=CC(=C(C=C2)OC)OCC3=CC=CC=C3)/C#N

InChI

InChI=1S/C21H18N2O2S/c1-15-14-26-21(23-15)18(12-22)10-17-8-9-19(24-2)20(11-17)25-13-16-6-4-3-5-7-16/h3-11,14H,13H2,1-2H3/b18-10+