4-methyl-3-[3-(3-methyl-4-propan-2-yl-phenoxy)propyl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-methyl-3-[3-(3-methyl-4-propan-2-yl-phenoxy)propyl]-1H-1,2,4-triazole-5-thione Openeye Name: 3-[3-(4-isopropyl-3-methyl-phenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 4-methyl-3-[3-(3-methyl-4-propan-2-ylphenoxy)propyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-methyl-3-[3-(3-methyl-4-propan-2-ylphenoxy)propyl]-1H-1,2,4-triazole-5-thione Traditional Name: 3-[3-(4-isopropyl-3-methyl-phenoxy)propyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C16H23N3OS MolecularWeight: 305.43832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC2=NNC(=S)N2C)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC2=NNC(=S)N2C)C(C)C

InChI

InChI=1S/C16H23N3OS/c1-11(2)14-8-7-13(10-12(14)3)20-9-5-6-15-17-18-16(21)19(15)4/h7-8,10-11H,5-6,9H2,1-4H3,(H,18,21)