(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl (E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl (E)-3-(5-bromanyl-2-methoxy-phenyl)prop-2-enoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl (E)-3-(5-bromo-2-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-2-propenoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl (E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)acrylic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C13H10BrClN2O3S MolecularWeight: 389.6521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)OCC2=C(SN=N2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)OCC2=C(SN=N2)Cl

InChI

InChI=1S/C13H10BrClN2O3S/c1-19-11-4-3-9(14)6-8(11)2-5-12(18)20-7-10-13(15)21-17-16-10/h2-6H,7H2,1H3/b5-2+