4-[2-(6-phenylpyrimidin-4-yl)sulfanylethyl]morpholin-4-ium

Systemtic Name: 4-[2-(6-phenylpyrimidin-4-yl)sulfanylethyl]morpholin-4-ium Openeye Name: 4-[2-(6-phenylpyrimidin-4-yl)sulfanylethyl]morpholin-4-ium CAS Name: 4-[2-[(6-phenyl-4-pyrimidinyl)thio]ethyl]morpholin-4-ium IUPAC Name: 4-[2-(6-phenylpyrimidin-4-yl)sulfanylethyl]morpholin-4-ium Traditional Name: 4-[2-[(6-phenylpyrimidin-4-yl)thio]ethyl]morpholin-4-ium Formula: C16H20N3OS+ MolecularWeight: 302.4145

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCSC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCSC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c1-2-4-14(5-3-1)15-12-16(18-13-17-15)21-11-8-19-6-9-20-10-7-19/h1-5,12-13H,6-11H2/p+1