4-[[2-[(4-tert-butylphenyl)methylsulfanyl]-6-methyl-pyrimidin-4-yl]methyl]morpholine

Systemtic Name: 4-[[2-[(4-tert-butylphenyl)methylsulfanyl]-6-methyl-pyrimidin-4-yl]methyl]morpholine Openeye Name: 4-[[2-[(4-tert-butylphenyl)methylsulfanyl]-6-methyl-pyrimidin-4-yl]methyl]morpholine CAS Name: 4-[[2-[(4-tert-butylphenyl)methylthio]-6-methyl-4-pyrimidinyl]methyl]morpholine IUPAC Name: 4-[[2-[(4-tert-butylphenyl)methylsulfanyl]-6-methylpyrimidin-4-yl]methyl]morpholine Traditional Name: 4-[[2-[(4-tert-butylbenzyl)thio]-6-methyl-pyrimidin-4-yl]methyl]morpholine Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(C)(C)C)CN3CCOCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(C)(C)C)CN3CCOCC3

InChI

InChI=1S/C21H29N3OS/c1-16-13-19(14-24-9-11-25-12-10-24)23-20(22-16)26-15-17-5-7-18(8-6-17)21(2,3)4/h5-8,13H,9-12,14-15H2,1-4H3