N-(4-ethoxyphenyl)-2-[5-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-(4-ethoxyphenyl)-2-[5-[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-[4-allyl-5-[2-(3-methylsulfanylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(4-ethoxyphenyl)acetamide CAS Name: N-(4-ethoxyphenyl)-2-[5-[[2-[3-(methylthio)anilino]-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(4-ethoxyphenyl)-2-[5-[2-(3-methylsulfanylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[4-allyl-5-[[2-keto-2-[3-(methylthio)anilino]ethyl]thio]-1,2,4-triazol-3-yl]-N-p-phenetyl-acetamide Formula: C24H27N5O3S2 MolecularWeight: 497.63288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)CC2=NN=C(N2CC=C)SCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)CC2=NN=C(N2CC=C)SCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C24H27N5O3S2/c1-4-13-29-21(15-22(30)25-17-9-11-19(12-10-17)32-5-2)27-28-24(29)34-16-23(31)26-18-7-6-8-20(14-18)33-3/h4,6-12,14H,1,5,13,15-16H2,2-3H3,(H,25,30)(H,26,31)