4-[6-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]pyridin-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]pyridin-3-yl]sulfonylmorpholine Openeye Name: 4-[[6-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-3-pyridyl]sulfonyl]morpholine CAS Name: 4-[[6-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-3-pyridinyl]sulfonyl]morpholine IUPAC Name: 4-[6-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]pyridin-3-yl]sulfonylmorpholine Traditional Name: 4-[[6-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-3-pyridyl]sulfonyl]morpholine Formula: C22H30N2O3S2 MolecularWeight: 434.6152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC=C(C=C2)S(=O)(=O)N3CCOCC3)C)C(C)(C)C

InChI

InChI=1S/C22H30N2O3S2/c1-16-12-18(22(3,4)5)13-17(2)20(16)15-28-21-7-6-19(14-23-21)29(25,26)24-8-10-27-11-9-24/h6-7,12-14H,8-11,15H2,1-5H3