3-[(3-chlorophenyl)methylsulfanyl]-4-(3-methylphenyl)-1,2,4-triazole

Systemtic Name: 3-[(3-chlorophenyl)methylsulfanyl]-4-(3-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(3-chlorophenyl)methylsulfanyl]-4-(m-tolyl)-1,2,4-triazole CAS Name: 3-[(3-chlorophenyl)methylthio]-4-(3-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(3-chlorophenyl)methylsulfanyl]-4-(3-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(3-chlorobenzyl)thio]-4-(m-tolyl)-1,2,4-triazole Formula: C16H14ClN3S MolecularWeight: 315.82046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=NN=C2SCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=CC=C1)N2C=NN=C2SCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H14ClN3S/c1-12-4-2-7-15(8-12)20-11-18-19-16(20)21-10-13-5-3-6-14(17)9-13/h2-9,11H,10H2,1H3