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3-Methyl-1-(phenylsulfonyl)-3-{3-N-(phenylsulfonyl)-N-[2-(imidazol-2-yl)-1-(methoxycarbonyl)ethyl]amino-2-methylenepropyl}-2,3-dihydro-1H-indole
SpectraBase Compound ID FNfEppPM1mL
InChI InChI=1S/C32H34N4O6S2/c1-24(21-32(2)23-36(28-17-11-10-16-27(28)32)44(40,41)26-14-8-5-9-15-26)22-35(43(38,39)25-12-6-4-7-13-25)29(31(37)42-3)20-30-33-18-19-34-30/h4-19,29H,1,20-23H2,2-3H3,(H,33,34)
InChIKey GUMITWLGWUNXFK-UHFFFAOYSA-N
Mol Weight 634.8 g/mol
Molecular Formula C32H34N4O6S2
Exact Mass 634.191977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NjFpaDOcuM
Name 3-Methyl-1-(phenylsulfonyl)-3-{3-N-(phenylsulfonyl)-N-[2-(imidazol-2-yl)-1-(methoxycarbonyl)ethyl]amino-2-methylenepropyl}-2,3-dihydro-1H-indole
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Formula C32H34N4O6S2
InChI InChI=1S/C32H34N4O6S2/c1-24(21-32(2)23-36(28-17-11-10-16-27(28)32)44(40,41)26-14-8-5-9-15-26)22-35(43(38,39)25-12-6-4-7-13-25)29(31(37)42-3)20-30-33-18-19-34-30/h4-19,29H,1,20-23H2,2-3H3,(H,33,34)
InChIKey GUMITWLGWUNXFK-UHFFFAOYSA-N
Molecular Weight 634.766 g/mol
SMILES [nH]1ccnc1CC(N(S(=O)(=O)c1ccccc1)CC(CC1(CN(S(=O)(=O)c2ccccc2)c2c1cccc2)C)=C)C(=O)OC
SPLASH splash10-003u-8920000000-c5e44de3c070eaccab23
Source of Spectrum F-57-613-12
Wiley ID 1549316