2-butan-2-yl-3-chloranyl-1H-1,2,4-triazol-5-one

Systemtic Name: 2-butan-2-yl-3-chloranyl-1H-1,2,4-triazol-5-one Openeye Name: 3-chloro-2-sec-butyl-1H-1,2,4-triazol-5-one CAS Name: 2-butan-2-yl-3-chloro-1H-1,2,4-triazol-5-one IUPAC Name: 2-butan-2-yl-3-chloro-1H-1,2,4-triazol-5-one Traditional Name: 3-chloro-2-sec-butyl-1H-1,2,4-triazol-5-one Formula: C6H10ClN3O MolecularWeight: 175.6161

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NC(=O)N1)Cl

Isomeric SMILES

CCC(C)N1C(=NC(=O)N1)Cl

InChI

InChI=1S/C6H10ClN3O/c1-3-4(2)10-5(7)8-6(11)9-10/h4H,3H2,1-2H3,(H,9,11)