4-[[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]sulfanylmethyl]quinoline

Systemtic Name: 4-[[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]sulfanylmethyl]quinoline Openeye Name: 4-[[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]sulfanylmethyl]quinoline CAS Name: 4-[[[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]thio]methyl]quinoline IUPAC Name: 4-[[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]sulfanylmethyl]quinoline Traditional Name: 4-[[[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenyl]thio]methyl]quinoline Formula: C20H19N3S MolecularWeight: 333.44996

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)C2=CC=CC=C2SCC3=CC=NC4=CC=CC=C34

Isomeric SMILES

C1CNC(=NC1)C2=CC=CC=C2SCC3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C20H19N3S/c1-3-8-18-16(6-1)15(10-13-21-18)14-24-19-9-4-2-7-17(19)20-22-11-5-12-23-20/h1-4,6-10,13H,5,11-12,14H2,(H,22,23)