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

Systemtic Name: N-[[5-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide Openeye Name: N-[[4-allyl-5-[2-(2,3-dimethylanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide CAS Name: N-[[5-[[2-(2,3-dimethylanilino)-2-oxoethyl]thio]-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide IUPAC Name: N-[[5-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl]methyl]-3-methylbenzamide Traditional Name: N-[[4-allyl-5-[[2-(2,3-dimethylanilino)-2-keto-ethyl]thio]-1,2,4-triazol-3-yl]methyl]-3-methyl-benzamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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