3-[4-[3-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]pyrazin-2-yl]piperazin-1-yl]-N,N-dimethyl-propan-1-amine

Systemtic Name: 3-[4-[3-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]pyrazin-2-yl]piperazin-1-yl]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[4-[3-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]pyrazin-2-yl]piperazin-1-yl]-N,N-dimethyl-propan-1-amine CAS Name: 3-[4-[3-[(5-bromo-2-methoxyphenyl)methylthio]-2-pyrazinyl]-1-piperazinyl]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[4-[3-[(5-bromo-2-methoxyphenyl)methylsulfanyl]pyrazin-2-yl]piperazin-1-yl]-N,N-dimethylpropan-1-amine Traditional Name: 3-[4-[3-[(5-bromo-2-methoxy-benzyl)thio]pyrazin-2-yl]piperazino]propyl-dimethyl-amine Formula: C21H30BrN5OS MolecularWeight: 480.4648

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1CCN(CC1)C2=NC=CN=C2SCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CN(C)CCCN1CCN(CC1)C2=NC=CN=C2SCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H30BrN5OS/c1-25(2)9-4-10-26-11-13-27(14-12-26)20-21(24-8-7-23-20)29-16-17-15-18(22)5-6-19(17)28-3/h5-8,15H,4,9-14,16H2,1-3H3