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

Systemtic Name: N-[(3,5-dimethylphenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)propanamide Openeye Name: N-[(3,5-dimethylphenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)propanamide CAS Name: N-[(3,5-dimethylphenyl)methylthio]-N-(1H-1,2,4-triazol-5-yl)propanamide IUPAC Name: N-[(3,5-dimethylphenyl)methylsulfanyl]-N-(1H-1,2,4-triazol-5-yl)propanamide Traditional Name: N-[(3,5-dimethylbenzyl)thio]-N-(1H-1,2,4-triazol-5-yl)propionamide Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=NC=NN1)SCC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCC(=O)N(C1=NC=NN1)SCC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C14H18N4OS/c1-4-13(19)18(14-15-9-16-17-14)20-8-12-6-10(2)5-11(3)7-12/h5-7,9H,4,8H2,1-3H3,(H,15,16,17)