2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-piperazin-1-yl-pyrazine

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-piperazin-1-yl-pyrazine Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-piperazin-1-yl-pyrazine CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylthio]-3-(1-piperazinyl)pyrazine IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-piperazin-1-ylpyrazine Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)thio]-3-piperazino-pyrazine Formula: C16H19BrN4OS MolecularWeight: 395.31726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=NC=CN=C2N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=NC=CN=C2N3CCNCC3

InChI

InChI=1S/C16H19BrN4OS/c1-22-14-3-2-13(17)10-12(14)11-23-16-15(19-4-5-20-16)21-8-6-18-7-9-21/h2-5,10,18H,6-9,11H2,1H3