(E)-N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]methyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]methyl]-3-(2-thienyl)acrylamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SC)CNC(=O)C=CC3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SC)CNC(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C18H18N4O2S2/c1-24-14-7-5-13(6-8-14)22-16(20-21-18(22)25-2)12-19-17(23)10-9-15-4-3-11-26-15/h3-11H,12H2,1-2H3,(H,19,23)/b10-9+