3-[(5-chloranylthiophen-2-yl)methylsulfanyl]-5-[(2-methylphenyl)methyl]-1H-1,2,4-triazole

Systemtic Name: 3-[(5-chloranylthiophen-2-yl)methylsulfanyl]-5-[(2-methylphenyl)methyl]-1H-1,2,4-triazole Openeye Name: 3-[(5-chloro-2-thienyl)methylsulfanyl]-5-(o-tolylmethyl)-1H-1,2,4-triazole CAS Name: 3-[(5-chloro-2-thiophenyl)methylthio]-5-[(2-methylphenyl)methyl]-1H-1,2,4-triazole IUPAC Name: 3-[(5-chlorothiophen-2-yl)methylsulfanyl]-5-[(2-methylphenyl)methyl]-1H-1,2,4-triazole Traditional Name: 3-[(5-chloro-2-thienyl)methylthio]-5-(2-methylbenzyl)-1H-1,2,4-triazole Formula: C15H14ClN3S2 MolecularWeight: 335.87476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=NC(=NN2)SCC3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC=CC=C1CC2=NC(=NN2)SCC3=CC=C(S3)Cl

InChI

InChI=1S/C15H14ClN3S2/c1-10-4-2-3-5-11(10)8-14-17-15(19-18-14)20-9-12-6-7-13(16)21-12/h2-7H,8-9H2,1H3,(H,17,18,19)