4-(3-chlorophenyl)-3-[(2,5-dimethylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-(3-chlorophenyl)-3-[(2,5-dimethylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-(3-chlorophenyl)-3-[(2,5-dimethylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(3-chlorophenyl)-3-[(2,5-dimethylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-(3-chlorophenyl)-3-[(2,5-dimethylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-(3-chlorophenyl)-3-[(2,5-dimethylbenzyl)thio]-1,2,4-triazole Formula: C17H16ClN3S MolecularWeight: 329.84704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H16ClN3S/c1-12-6-7-13(2)14(8-12)10-22-17-20-19-11-21(17)16-5-3-4-15(18)9-16/h3-9,11H,10H2,1-2H3