3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole

Systemtic Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole Openeye Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole CAS Name: 3-[(3,4-dichlorophenyl)methylthio]-5-(4-ethylphenyl)-1H-1,2,4-triazole IUPAC Name: 3-[(3,4-dichlorophenyl)methylsulfanyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole Traditional Name: 3-[(3,4-dichlorobenzyl)thio]-5-(4-ethylphenyl)-1H-1,2,4-triazole Formula: C17H15Cl2N3S MolecularWeight: 364.2921

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H15Cl2N3S/c1-2-11-3-6-13(7-4-11)16-20-17(22-21-16)23-10-12-5-8-14(18)15(19)9-12/h3-9H,2,10H2,1H3,(H,20,21,22)