3-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-N-[3-(2-methylpiperidin-1-yl)propyl]quinoxalin-2-amine

Systemtic Name: 3-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-N-[3-(2-methylpiperidin-1-yl)propyl]quinoxalin-2-amine Openeye Name: 3-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-N-[3-(2-methyl-1-piperidyl)propyl]quinoxalin-2-amine CAS Name: 3-[(5-bromo-2-methoxyphenyl)methylthio]-N-[3-(2-methyl-1-piperidinyl)propyl]-2-quinoxalinamine IUPAC Name: 3-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-N-[3-(2-methylpiperidin-1-yl)propyl]quinoxalin-2-amine Traditional Name: [3-[(5-bromo-2-methoxy-benzyl)thio]quinoxalin-2-yl]-[3-(2-methylpiperidino)propyl]amine Formula: C25H31BrN4OS MolecularWeight: 515.50884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC2=NC3=CC=CC=C3N=C2SCC4=C(C=CC(=C4)Br)OC

Isomeric SMILES

CC1CCCCN1CCCNC2=NC3=CC=CC=C3N=C2SCC4=C(C=CC(=C4)Br)OC

InChI

InChI=1S/C25H31BrN4OS/c1-18-8-5-6-14-30(18)15-7-13-27-24-25(29-22-10-4-3-9-21(22)28-24)32-17-19-16-20(26)11-12-23(19)31-2/h3-4,9-12,16,18H,5-8,13-15,17H2,1-2H3,(H,27,28)