(3,5-ditert-butyl-5-oxidanyl-4H-pyrazol-1-yl)-phenyl-methanethione

Systemtic Name: (3,5-ditert-butyl-5-oxidanyl-4H-pyrazol-1-yl)-phenyl-methanethione Openeye Name: (3,5-ditert-butyl-5-hydroxy-4H-pyrazol-1-yl)-phenyl-methanethione CAS Name: (3,5-ditert-butyl-5-hydroxy-4H-pyrazol-1-yl)-phenylmethanethione IUPAC Name: (3,5-ditert-butyl-5-hydroxy-4H-pyrazol-1-yl)-phenylmethanethione Traditional Name: (3,5-ditert-butyl-5-hydroxy-2-pyrazolin-1-yl)-phenyl-methanethione Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(C1)(C(C)(C)C)O)C(=S)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=NN(C(C1)(C(C)(C)C)O)C(=S)C2=CC=CC=C2

InChI

InChI=1S/C18H26N2OS/c1-16(2,3)14-12-18(21,17(4,5)6)20(19-14)15(22)13-10-8-7-9-11-13/h7-11,21H,12H2,1-6H3