3-butyl-5-[(2,4-dichlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-butyl-5-[(2,4-dichlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-butyl-5-[(2,4-dichlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-butyl-5-[(2,4-dichlorophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-butyl-5-[(2,4-dichlorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-butyl-5-[(2,4-dichlorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C13H16Cl2N4S MolecularWeight: 331.26394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1N)SCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCCCC1=NN=C(N1N)SCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H16Cl2N4S/c1-2-3-4-12-17-18-13(19(12)16)20-8-9-5-6-10(14)7-11(9)15/h5-7H,2-4,8,16H2,1H3