N-[5-[(2,4-dimethylphenyl)methylsulfanyl]-1-ethanoyl-1,2,4-triazol-3-yl]ethanamide

Systemtic Name: N-[5-[(2,4-dimethylphenyl)methylsulfanyl]-1-ethanoyl-1,2,4-triazol-3-yl]ethanamide Openeye Name: N-[1-acetyl-5-[(2,4-dimethylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]acetamide CAS Name: N-[1-acetyl-5-[(2,4-dimethylphenyl)methylthio]-1,2,4-triazol-3-yl]acetamide IUPAC Name: N-[1-acetyl-5-[(2,4-dimethylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]acetamide Traditional Name: N-[1-acetyl-5-[(2,4-dimethylbenzyl)thio]-1,2,4-triazol-3-yl]acetamide Formula: C15H18N4O2S MolecularWeight: 318.39402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC2=NC(=NN2C(=O)C)NC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)CSC2=NC(=NN2C(=O)C)NC(=O)C)C

InChI

InChI=1S/C15H18N4O2S/c1-9-5-6-13(10(2)7-9)8-22-15-17-14(16-11(3)20)18-19(15)12(4)21/h5-7H,8H2,1-4H3,(H,16,18,20)