1-(4-chlorophenyl)sulfanyl-3,3-dimethyl-2-(1,2,4-triazol-1-ylmethyl)butan-2-ol

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1C=NC=N1)(CSC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC(C)(C)C(CN1C=NC=N1)(CSC2=CC=C(C=C2)Cl)O

InChI

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