N-[[3-methyl-4-[3-[(1-methylpiperidin-3-yl)methylsulfanyl]propylsulfanyl]pyridin-2-yl]methyl]quinolin-3-amine

Systemtic Name: N-[[3-methyl-4-[3-[(1-methylpiperidin-3-yl)methylsulfanyl]propylsulfanyl]pyridin-2-yl]methyl]quinolin-3-amine Openeye Name: N-[[3-methyl-4-[3-[(1-methyl-3-piperidyl)methylsulfanyl]propylsulfanyl]-2-pyridyl]methyl]quinolin-3-amine CAS Name: N-[[3-methyl-4-[3-[(1-methyl-3-piperidinyl)methylthio]propylthio]-2-pyridinyl]methyl]-3-quinolinamine IUPAC Name: N-[[3-methyl-4-[3-[(1-methylpiperidin-3-yl)methylsulfanyl]propylsulfanyl]pyridin-2-yl]methyl]quinolin-3-amine Traditional Name: [3-methyl-4-[3-[(1-methyl-3-piperidyl)methylthio]propylthio]-2-pyridyl]methyl-(3-quinolyl)amine Formula: C26H34N4S2 MolecularWeight: 466.70496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CNC2=CC3=CC=CC=C3N=C2)SCCCSCC4CCCN(C4)C

Isomeric SMILES

CC1=C(C=CN=C1CNC2=CC3=CC=CC=C3N=C2)SCCCSCC4CCCN(C4)C

InChI

InChI=1S/C26H34N4S2/c1-20-25(17-28-23-15-22-8-3-4-9-24(22)29-16-23)27-11-10-26(20)32-14-6-13-31-19-21-7-5-12-30(2)18-21/h3-4,8-11,15-16,21,28H,5-7,12-14,17-19H2,1-2H3