1-(4-chlorophenyl)sulfanyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol

Systemtic Name: 1-(4-chlorophenyl)sulfanyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol Openeye Name: 1-(4-chlorophenyl)sulfanyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol CAS Name: 1-[(4-chlorophenyl)thio]-4,4-dimethyl-2-(1,2,4-triazol-1-yl)-3-pentanol IUPAC Name: 1-(4-chlorophenyl)sulfanyl-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol Traditional Name: 1-[(4-chlorophenyl)thio]-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol Formula: C15H20ClN3OS MolecularWeight: 325.8568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CSC1=CC=C(C=C1)Cl)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CSC1=CC=C(C=C1)Cl)N2C=NC=N2)O

InChI

InChI=1S/C15H20ClN3OS/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-21-12-6-4-11(16)5-7-12/h4-7,9-10,13-14,20H,8H2,1-3H3