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

Systemtic Name: 4-[2-(4-chlorophenyl)-6-propan-2-yl-pyrimidin-4-yl]-4-oxidanidyl-thiomorpholin-4-ium Openeye Name: 4-[2-(4-chlorophenyl)-6-isopropyl-pyrimidin-4-yl]-4-oxido-thiomorpholin-4-ium CAS Name: 4-[2-(4-chlorophenyl)-6-propan-2-yl-4-pyrimidinyl]-4-oxidothiomorpholin-4-ium IUPAC Name: 4-[2-(4-chlorophenyl)-6-propan-2-ylpyrimidin-4-yl]-4-oxidothiomorpholin-4-ium Traditional Name: 4-[2-(4-chlorophenyl)-6-isopropyl-pyrimidin-4-yl]-4-oxido-thiomorpholin-4-ium Formula: C17H20ClN3OS MolecularWeight: 349.8782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=NC(=N1)C2=CC=C(C=C2)Cl)[N+]3(CCSCC3)[O-]

Isomeric SMILES

CC(C)C1=CC(=NC(=N1)C2=CC=C(C=C2)Cl)[N+]3(CCSCC3)[O-]

InChI

InChI=1S/C17H20ClN3OS/c1-12(2)15-11-16(21(22)7-9-23-10-8-21)20-17(19-15)13-3-5-14(18)6-4-13/h3-6,11-12H,7-10H2,1-2H3