N-(3-methoxyphenyl)-2-[3-[(4-methylphenyl)sulfanylmethyl]-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl]ethanamide

Systemtic Name: N-(3-methoxyphenyl)-2-[3-[(4-methylphenyl)sulfanylmethyl]-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl]ethanamide Openeye Name: 2-[4-allyl-3-(p-tolylsulfanylmethyl)-5-thioxo-1,2,4-triazol-1-yl]-N-(3-methoxyphenyl)acetamide CAS Name: N-(3-methoxyphenyl)-2-[3-[[(4-methylphenyl)thio]methyl]-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl]acetamide IUPAC Name: N-(3-methoxyphenyl)-2-[3-[(4-methylphenyl)sulfanylmethyl]-4-prop-2-enyl-5-sulfanylidene-1,2,4-triazol-1-yl]acetamide Traditional Name: 2-[4-allyl-3-[(p-tolylthio)methyl]-5-thioxo-1,2,4-triazol-1-yl]-N-(3-methoxyphenyl)acetamide Formula: C22H24N4O2S2 MolecularWeight: 440.58156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=NN(C(=S)N2CC=C)CC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=NN(C(=S)N2CC=C)CC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H24N4O2S2/c1-4-12-25-20(15-30-19-10-8-16(2)9-11-19)24-26(22(25)29)14-21(27)23-17-6-5-7-18(13-17)28-3/h4-11,13H,1,12,14-15H2,2-3H3,(H,23,27)