3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole

Systemtic Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole Openeye Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(2-thienylmethyl)-1H-1,2,4-triazole CAS Name: 3-[2-(3,5-dimethylphenoxy)ethylthio]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole IUPAC Name: 3-[2-(3,5-dimethylphenoxy)ethylsulfanyl]-5-(thiophen-2-ylmethyl)-1H-1,2,4-triazole Traditional Name: 3-[2-(3,5-dimethylphenoxy)ethylthio]-5-(2-thenyl)-1H-1,2,4-triazole Formula: C17H19N3OS2 MolecularWeight: 345.48226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCSC2=NNC(=N2)CC3=CC=CS3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCSC2=NNC(=N2)CC3=CC=CS3)C

InChI

InChI=1S/C17H19N3OS2/c1-12-8-13(2)10-14(9-12)21-5-7-23-17-18-16(19-20-17)11-15-4-3-6-22-15/h3-4,6,8-10H,5,7,11H2,1-2H3,(H,18,19,20)