2-[3-(3-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-(3-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-(2-methylallylsulfanyl)-5-(m-tolyl)-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-(3-methylphenyl)-5-(2-methylprop-2-enylthio)-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-(3-methylphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-(2-methylallylthio)-5-(m-tolyl)-1,2,4-triazol-4-yl]acetamide Formula: C15H18N4OS MolecularWeight: 302.39462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC(=O)N)SCC(=C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC(=O)N)SCC(=C)C

InChI

InChI=1S/C15H18N4OS/c1-10(2)9-21-15-18-17-14(19(15)8-13(16)20)12-6-4-5-11(3)7-12/h4-7H,1,8-9H2,2-3H3,(H2,16,20)