N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-2-(2,4-dimethylphenyl)-5-methyl-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-2-(2,4-dimethylphenyl)-5-methyl-4-triazolecarboxamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-2-(2,4-dimethylphenyl)-5-methyltriazole-4-carboxamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-2-(2,4-dimethylphenyl)-5-methyl-triazole-4-carboxamide Formula: C19H19ClN4O3S MolecularWeight: 418.89716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2N=C(C(=N2)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl)C)C

InChI

InChI=1S/C19H19ClN4O3S/c1-11-5-8-17(12(2)9-11)24-22-13(3)18(23-24)19(25)21-16-10-14(28(4,26)27)6-7-15(16)20/h5-10H,1-4H3,(H,21,25)