[1-tert-butyl-3-(2-methoxyphenyl)pyrazol-4-yl]methanethiol

Systemtic Name: [1-tert-butyl-3-(2-methoxyphenyl)pyrazol-4-yl]methanethiol Openeye Name: [1-tert-butyl-3-(2-methoxyphenyl)pyrazol-4-yl]methanethiol CAS Name: [1-tert-butyl-3-(2-methoxyphenyl)-4-pyrazolyl]methanethiol IUPAC Name: [1-tert-butyl-3-(2-methoxyphenyl)pyrazol-4-yl]methanethiol Traditional Name: [1-tert-butyl-3-(2-methoxyphenyl)pyrazol-4-yl]methanethiol Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=N1)C2=CC=CC=C2OC)CS

Isomeric SMILES

CC(C)(C)N1C=C(C(=N1)C2=CC=CC=C2OC)CS

InChI

InChI=1S/C15H20N2OS/c1-15(2,3)17-9-11(10-19)14(16-17)12-7-5-6-8-13(12)18-4/h5-9,19H,10H2,1-4H3