(Z)-3-(2-ethoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate

Systemtic Name: (Z)-3-(2-ethoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Openeye Name: (Z)-3-(2-ethoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate CAS Name: (Z)-3-(2-ethoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-2-propenoate IUPAC Name: (Z)-3-(2-ethoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoate Traditional Name: (Z)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-3-o-phenetyl-acrylate Formula: C14H14N3O3S- MolecularWeight: 304.34426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C=C(C(=O)[O-])SC2=NNC(=N2)C

Isomeric SMILES

CCOC1=CC=CC=C1/C=C(/C(=O)[O-])\SC2=NNC(=N2)C

InChI

InChI=1S/C14H15N3O3S/c1-3-20-11-7-5-4-6-10(11)8-12(13(18)19)21-14-15-9(2)16-17-14/h4-8H,3H2,1-2H3,(H,18,19)(H,15,16,17)/p-1/b12-8-