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

Systemtic Name: 5-[(2,5-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[(2,5-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[(2,5-dimethylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-[(2,5-dimethylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-[(2,5-dimethylbenzyl)thio]-1H-1,2,4-triazole Formula: C11H13N3S MolecularWeight: 219.30602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC=NN2

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC=NN2

InChI

InChI=1S/C11H13N3S/c1-8-3-4-9(2)10(5-8)6-15-11-12-7-13-14-11/h3-5,7H,6H2,1-2H3,(H,12,13,14)