8-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]quinoline

Systemtic Name: 8-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]quinoline Openeye Name: 8-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]quinoline CAS Name: 8-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]quinoline IUPAC Name: 8-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]quinoline Traditional Name: 8-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]quinoline Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=CC3=C2N=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=CC3=C2N=CC=C3)C

InChI

InChI=1S/C16H15N3S/c1-11-9-12(2)19-16(18-11)20-10-14-6-3-5-13-7-4-8-17-15(13)14/h3-9H,10H2,1-2H3