3-[(2-chloranylphenoxy)methyl]-4-pentan-3-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(2-chloranylphenoxy)methyl]-4-pentan-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-chlorophenoxy)methyl]-4-(1-ethylpropyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-chlorophenoxy)methyl]-4-pentan-3-yl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-chlorophenoxy)methyl]-4-pentan-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(2-chlorophenoxy)methyl]-4-(1-ethylpropyl)-1H-1,2,4-triazole-5-thione Formula: C14H18ClN3OS MolecularWeight: 311.83022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=NNC1=S)COC2=CC=CC=C2Cl

Isomeric SMILES

CCC(CC)N1C(=NNC1=S)COC2=CC=CC=C2Cl

InChI

InChI=1S/C14H18ClN3OS/c1-3-10(4-2)18-13(16-17-14(18)20)9-19-12-8-6-5-7-11(12)15/h5-8,10H,3-4,9H2,1-2H3,(H,17,20)