2-[bis(3-propan-2-ylpyrazol-1-yl)methyl]-6-tert-butyl-4-methyl-benzenethiol

Systemtic Name: 2-[bis(3-propan-2-ylpyrazol-1-yl)methyl]-6-tert-butyl-4-methyl-benzenethiol Openeye Name: 2-[bis(3-isopropylpyrazol-1-yl)methyl]-6-tert-butyl-4-methyl-benzenethiol CAS Name: 2-[bis(3-propan-2-yl-1-pyrazolyl)methyl]-6-tert-butyl-4-methylbenzenethiol IUPAC Name: 2-[bis(3-propan-2-ylpyrazol-1-yl)methyl]-6-tert-butyl-4-methylbenzenethiol Traditional Name: 2-[bis(3-isopropylpyrazol-1-yl)methyl]-6-tert-butyl-4-methyl-benzenethiol Formula: C24H34N4S MolecularWeight: 410.61856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)S)C(N2C=CC(=N2)C(C)C)N3C=CC(=N3)C(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)S)C(N2C=CC(=N2)C(C)C)N3C=CC(=N3)C(C)C

InChI

InChI=1S/C24H34N4S/c1-15(2)20-9-11-27(25-20)23(28-12-10-21(26-28)16(3)4)18-13-17(5)14-19(22(18)29)24(6,7)8/h9-16,23,29H,1-8H3