2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-piperazin-1-yl-6,7-dihydroquinoxaline

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-piperazin-1-yl-6,7-dihydroquinoxaline Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-piperazin-1-yl-6,7-dihydroquinoxaline CAS Name: 2-[(5-bromo-2-methoxyphenyl)methylthio]-3-(1-piperazinyl)-6,7-dihydroquinoxaline IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-piperazin-1-yl-6,7-dihydroquinoxaline Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)thio]-3-piperazino-6,7-dihydroquinoxaline Formula: C20H23BrN4OS MolecularWeight: 447.39182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=NC3=CCCC=C3N=C2N4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=NC3=CCCC=C3N=C2N4CCNCC4

InChI

InChI=1S/C20H23BrN4OS/c1-26-18-7-6-15(21)12-14(18)13-27-20-19(25-10-8-22-9-11-25)23-16-4-2-3-5-17(16)24-20/h4-7,12,22H,2-3,8-11,13H2,1H3