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

Systemtic Name: 2-chloranyl-N-phenyl-N-(1,2,4-triazol-4-ylmethyl)butanamide Openeye Name: 2-chloro-N-phenyl-N-(1,2,4-triazol-4-ylmethyl)butanamide CAS Name: 2-chloro-N-phenyl-N-(1,2,4-triazol-4-ylmethyl)butanamide IUPAC Name: 2-chloro-N-phenyl-N-(1,2,4-triazol-4-ylmethyl)butanamide Traditional Name: 2-chloro-N-phenyl-N-(1,2,4-triazol-4-ylmethyl)butyramide Formula: C13H15ClN4O MolecularWeight: 278.7374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CN1C=NN=C1)C2=CC=CC=C2)Cl

Isomeric SMILES

CCC(C(=O)N(CN1C=NN=C1)C2=CC=CC=C2)Cl

InChI

InChI=1S/C13H15ClN4O/c1-2-12(14)13(19)18(10-17-8-15-16-9-17)11-6-4-3-5-7-11/h3-9,12H,2,10H2,1H3