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

Systemtic Name: N-(3,4-dimethylphenyl)-2-[5-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: 2-[4-allyl-5-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]-N-(3,4-dimethylphenyl)acetamide CAS Name: N-(3,4-dimethylphenyl)-2-[5-[[2-(3-methylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(3,4-dimethylphenyl)-2-[5-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]acetamide Traditional Name: 2-[4-allyl-5-[[2-keto-2-(m-toluidino)ethyl]thio]-1,2,4-triazol-3-yl]-N-(3,4-dimethylphenyl)acetamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)CC(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C24H27N5O2S/c1-5-11-29-21(14-22(30)25-20-10-9-17(3)18(4)13-20)27-28-24(29)32-15-23(31)26-19-8-6-7-16(2)12-19/h5-10,12-13H,1,11,14-15H2,2-4H3,(H,25,30)(H,26,31)