N-(2-chloranyl-5-methyl-phenyl)-4,4-dimethyl-2-(4-methyl-1,2,3-triazol-2-yl)-3-oxidanylidene-pentanamide

Systemtic Name: N-(2-chloranyl-5-methyl-phenyl)-4,4-dimethyl-2-(4-methyl-1,2,3-triazol-2-yl)-3-oxidanylidene-pentanamide Openeye Name: N-(2-chloro-5-methyl-phenyl)-4,4-dimethyl-2-(4-methyltriazol-2-yl)-3-oxo-pentanamide CAS Name: N-(2-chloro-5-methylphenyl)-4,4-dimethyl-2-(4-methyl-2-triazolyl)-3-oxopentanamide IUPAC Name: N-(2-chloro-5-methylphenyl)-4,4-dimethyl-2-(4-methyltriazol-2-yl)-3-oxopentanamide Traditional Name: N-(2-chloro-5-methyl-phenyl)-3-keto-4,4-dimethyl-2-(4-methyltriazol-2-yl)valeramide Formula: C17H21ClN4O2 MolecularWeight: 348.82724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)N2N=CC(=N2)C

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)N2N=CC(=N2)C

InChI

InChI=1S/C17H21ClN4O2/c1-10-6-7-12(18)13(8-10)20-16(24)14(15(23)17(3,4)5)22-19-9-11(2)21-22/h6-9,14H,1-5H3,(H,20,24)