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

Systemtic Name: N-(3-chlorophenyl)-2-[5-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-(3-chlorophenyl)-2-[5-[2-(3,5-dimethylanilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]acetamide CAS Name: N-(3-chlorophenyl)-2-[5-[[2-(3,5-dimethylanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-(3-chlorophenyl)-2-[5-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]acetamide Traditional Name: N-(3-chlorophenyl)-2-[5-[[2-(3,5-dimethylanilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]acetamide Formula: C21H22ClN5O2S MolecularWeight: 443.94968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2C)CC(=O)NC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C21H22ClN5O2S/c1-13-7-14(2)9-17(8-13)24-20(29)12-30-21-26-25-18(27(21)3)11-19(28)23-16-6-4-5-15(22)10-16/h4-10H,11-12H2,1-3H3,(H,23,28)(H,24,29)