2-chloranyl-N-(2-ethyl-4-methyl-phenyl)-N-(1,2,4-triazol-1-ylmethyl)butanamide

Systemtic Name: 2-chloranyl-N-(2-ethyl-4-methyl-phenyl)-N-(1,2,4-triazol-1-ylmethyl)butanamide Openeye Name: 2-chloro-N-(2-ethyl-4-methyl-phenyl)-N-(1,2,4-triazol-1-ylmethyl)butanamide CAS Name: 2-chloro-N-(2-ethyl-4-methylphenyl)-N-(1,2,4-triazol-1-ylmethyl)butanamide IUPAC Name: 2-chloro-N-(2-ethyl-4-methylphenyl)-N-(1,2,4-triazol-1-ylmethyl)butanamide Traditional Name: 2-chloro-N-(2-ethyl-4-methyl-phenyl)-N-(1,2,4-triazol-1-ylmethyl)butyramide Formula: C16H21ClN4O MolecularWeight: 320.81714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C)N(CN2C=NC=N2)C(=O)C(CC)Cl

Isomeric SMILES

CCC1=C(C=CC(=C1)C)N(CN2C=NC=N2)C(=O)C(CC)Cl

InChI

InChI=1S/C16H21ClN4O/c1-4-13-8-12(3)6-7-15(13)21(16(22)14(17)5-2)11-20-10-18-9-19-20/h6-10,14H,4-5,11H2,1-3H3