2,9-dimethyl-5-(oxan-2-ylsulfanyl)-1,2,9,10-tetrahydro-1,10-phenanthroline

Systemtic Name: 2,9-dimethyl-5-(oxan-2-ylsulfanyl)-1,2,9,10-tetrahydro-1,10-phenanthroline Openeye Name: 2,9-dimethyl-5-tetrahydropyran-2-ylsulfanyl-1,2,9,10-tetrahydro-1,10-phenanthroline CAS Name: 2,9-dimethyl-5-(2-oxanylthio)-1,2,9,10-tetrahydro-1,10-phenanthroline IUPAC Name: 2,9-dimethyl-5-(oxan-2-ylsulfanyl)-1,2,9,10-tetrahydro-1,10-phenanthroline Traditional Name: 2,9-dimethyl-5-(tetrahydropyran-2-ylthio)-1,2,9,10-tetrahydro-1,10-phenanthroline Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC2=CC(=C3C=CC(NC3=C2N1)C)SC4CCCCO4

Isomeric SMILES

CC1C=CC2=CC(=C3C=CC(NC3=C2N1)C)SC4CCCCO4

InChI

InChI=1S/C19H24N2OS/c1-12-6-8-14-11-16(23-17-5-3-4-10-22-17)15-9-7-13(2)21-19(15)18(14)20-12/h6-9,11-13,17,20-21H,3-5,10H2,1-2H3