N-[[3-methyl-4-[2-[2-(pyridin-3-ylmethylsulfanyl)ethoxy]ethoxy]pyridin-2-yl]methyl]quinolin-3-amine

Systemtic Name: N-[[3-methyl-4-[2-[2-(pyridin-3-ylmethylsulfanyl)ethoxy]ethoxy]pyridin-2-yl]methyl]quinolin-3-amine Openeye Name: N-[[3-methyl-4-[2-[2-(3-pyridylmethylsulfanyl)ethoxy]ethoxy]-2-pyridyl]methyl]quinolin-3-amine CAS Name: N-[[3-methyl-4-[2-[2-(3-pyridinylmethylthio)ethoxy]ethoxy]-2-pyridinyl]methyl]-3-quinolinamine IUPAC Name: N-[[3-methyl-4-[2-[2-(pyridin-3-ylmethylsulfanyl)ethoxy]ethoxy]pyridin-2-yl]methyl]quinolin-3-amine Traditional Name: [3-methyl-4-[2-[2-(3-pyridylmethylthio)ethoxy]ethoxy]-2-pyridyl]methyl-(3-quinolyl)amine Formula: C26H28N4O2S MolecularWeight: 460.59112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CNC2=CC3=CC=CC=C3N=C2)OCCOCCSCC4=CN=CC=C4

Isomeric SMILES

CC1=C(C=CN=C1CNC2=CC3=CC=CC=C3N=C2)OCCOCCSCC4=CN=CC=C4

InChI

InChI=1S/C26H28N4O2S/c1-20-25(18-29-23-15-22-6-2-3-7-24(22)30-17-23)28-10-8-26(20)32-12-11-31-13-14-33-19-21-5-4-9-27-16-21/h2-10,15-17,29H,11-14,18-19H2,1H3