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

Systemtic Name: (E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(4-bromophenyl)thiazol-2-yl]-3-(3-ethoxy-4-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[4-(4-bromophenyl)-2-thiazolyl]-3-(3-ethoxy-4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(3-ethoxy-4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(4-bromophenyl)thiazol-2-yl]-3-(3-ethoxy-4-methoxy-phenyl)acrylonitrile Formula: C21H17BrN2O2S MolecularWeight: 441.34088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C21H17BrN2O2S/c1-3-26-20-11-14(4-9-19(20)25-2)10-16(12-23)21-24-18(13-27-21)15-5-7-17(22)8-6-15/h4-11,13H,3H2,1-2H3/b16-10+