5-cyclopentyl-3-[3-(3,5-dimethylphenoxy)propylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-cyclopentyl-3-[3-(3,5-dimethylphenoxy)propylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-cyclopentyl-3-[3-(3,5-dimethylphenoxy)propylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-cyclopentyl-3-[3-(3,5-dimethylphenoxy)propylthio]-1H-1,2,4-triazole IUPAC Name: 5-cyclopentyl-3-[3-(3,5-dimethylphenoxy)propylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-cyclopentyl-3-[3-(3,5-dimethylphenoxy)propylthio]-1H-1,2,4-triazole Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCSC2=NNC(=N2)C3CCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCSC2=NNC(=N2)C3CCCC3)C

InChI

InChI=1S/C18H25N3OS/c1-13-10-14(2)12-16(11-13)22-8-5-9-23-18-19-17(20-21-18)15-6-3-4-7-15/h10-12,15H,3-9H2,1-2H3,(H,19,20,21)