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

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: (2-phenylthiazol-4-yl)methyl 3-[4-(cyanomethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: 3-[4-(cyanomethoxy)-3-methoxyphenyl]-2-propenoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[4-(cyanomethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: 3-[4-(cyanomethoxy)-3-methoxy-phenyl]acrylic acid (2-phenylthiazol-4-yl)methyl ester Formula: C22H18N2O4S MolecularWeight: 406.45432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC2=CSC(=N2)C3=CC=CC=C3)OCC#N

Isomeric SMILES

COC1=C(C=CC(=C1)C=CC(=O)OCC2=CSC(=N2)C3=CC=CC=C3)OCC#N

InChI

InChI=1S/C22H18N2O4S/c1-26-20-13-16(7-9-19(20)27-12-11-23)8-10-21(25)28-14-18-15-29-22(24-18)17-5-3-2-4-6-17/h2-10,13,15H,12,14H2,1H3