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1-{[2-(benzylsulfanyl)phenyl]carbonyl}-4-(4-methoxy-2-nitrophenyl)piperazine
SpectraBase Compound ID G1p4UB90bi6
InChI InChI=1S/C25H25N3O4S/c1-32-20-11-12-22(23(17-20)28(30)31)26-13-15-27(16-14-26)25(29)21-9-5-6-10-24(21)33-18-19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3
InChIKey GZWPPBWKZXMIOZ-UHFFFAOYSA-N
Mol Weight 463.55 g/mol
Molecular Formula C25H25N3O4S
Exact Mass 463.156577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKllNq9qegg
Name 1-{[2-(benzylsulfanyl)phenyl]carbonyl}-4-(4-methoxy-2-nitrophenyl)piperazine
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Formula C25H25N3O4S
InChI InChI=1S/C25H25N3O4S/c1-32-20-11-12-22(23(17-20)28(30)31)26-13-15-27(16-14-26)25(29)21-9-5-6-10-24(21)33-18-19-7-3-2-4-8-19/h2-12,17H,13-16,18H2,1H3
InChIKey GZWPPBWKZXMIOZ-UHFFFAOYSA-N
Molecular Weight 463.552 g/mol
SMILES c1(N(=O)=O)c(N2CCN(C(c3c(SCc4ccccc4)cccc3)=O)CC2)ccc(c1)OC
SPLASH splash10-0006-9810000000-a25947ffc7c0442f995c
Source of Spectrum IY-2-5215-1
Synonyms Piperazine, 1-(4-methoxy-2-nitrophenyl)-4-[2-[(phenylmethyl)thio]benzoyl]- [4-(4-methoxy-2-nitrophenyl)-1-piperazinyl]-[2-(phenylmethylthio)phenyl]methanone (2-benzylsulfanylphenyl)-[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]methanone (2-benzylsulfanylphenyl)-[4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]methanone [4-(4-methoxy-2-nitro-phenyl)piperazin-1-yl]-[2-(phenylmethylsulfanyl)phenyl]methanone
Wiley ID 1660134