4-[2-(4-methylphenyl)-6-propan-2-yl-pyrimidin-4-yl]-4-oxidanidyl-thiomorpholin-4-ium

Systemtic Name: 4-[2-(4-methylphenyl)-6-propan-2-yl-pyrimidin-4-yl]-4-oxidanidyl-thiomorpholin-4-ium Openeye Name: 4-[6-isopropyl-2-(p-tolyl)pyrimidin-4-yl]-4-oxido-thiomorpholin-4-ium CAS Name: 4-[2-(4-methylphenyl)-6-propan-2-yl-4-pyrimidinyl]-4-oxidothiomorpholin-4-ium IUPAC Name: 4-[2-(4-methylphenyl)-6-propan-2-ylpyrimidin-4-yl]-4-oxidothiomorpholin-4-ium Traditional Name: 4-[6-isopropyl-2-(p-tolyl)pyrimidin-4-yl]-4-oxido-thiomorpholin-4-ium Formula: C18H23N3OS MolecularWeight: 329.45972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CC(=N2)[N+]3(CCSCC3)[O-])C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CC(=N2)[N+]3(CCSCC3)[O-])C(C)C

InChI

InChI=1S/C18H23N3OS/c1-13(2)16-12-17(21(22)8-10-23-11-9-21)20-18(19-16)15-6-4-14(3)5-7-15/h4-7,12-13H,8-11H2,1-3H3