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N-[2-[4-[ethyl-[3-(isopropylamino)-2-pyridyl]amino]piperidine-1-carbonyl]-1H-indol-5-yl]-4-methyl-piperazine-1-sulfonamide
SpectraBase Compound ID KxPRtL4nbbs
InChI InChI=1S/C29H42N8O3S/c1-5-37(28-26(31-21(2)3)7-6-12-30-28)24-10-13-35(14-11-24)29(38)27-20-22-19-23(8-9-25(22)32-27)33-41(39,40)36-17-15-34(4)16-18-36/h6-9,12,19-21,24,31-33H,5,10-11,13-18H2,1-4H3
InChIKey KNRHBEZSQPGTIN-UHFFFAOYSA-N
Mol Weight 582.8 g/mol
Molecular Formula C29H42N8O3S
Exact Mass 582.310058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2uuQrU0hpw
Name N-[2-[4-[ethyl-[3-(isopropylamino)-2-pyridyl]amino]piperidine-1-carbonyl]-1H-indol-5-yl]-4-methyl-piperazine-1-sulfonamide
Alternate Name(s) N-[2-[4-[ethyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]piperidin-1-yl]carbonyl-1H-indol-5-yl]-4-methyl-piperazine-1-sulfonamide N-[2-[4-[ethyl-[3-(propan-2-ylamino)pyridin-2-yl]amino]piperidine-1-carbonyl]-1H-indol-5-yl]-4-methylpiperazine-1-sulfonamide N-[2-[[4-[ethyl-[3-(propan-2-ylamino)-2-pyridinyl]amino]-1-piperidinyl]-oxomethyl]-1H-indol-5-yl]-4-methyl-1-piperazinesulfonamide
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Formula C29H42N8O3S
InChI InChI=1S/C29H42N8O3S/c1-5-37(28-26(31-21(2)3)7-6-12-30-28)24-10-13-35(14-11-24)29(38)27-20-22-19-23(8-9-25(22)32-27)33-41(39,40)36-17-15-34(4)16-18-36/h6-9,12,19-21,24,31-33H,5,10-11,13-18H2,1-4H3
InChIKey KNRHBEZSQPGTIN-UHFFFAOYSA-N
Molecular Weight 582.768 g/mol
SMILES N(S(N1CCN(CC1)C)(=O)=O)c1ccc2[nH]c(cc2c1)C(N1CCC(N(c2c(NC(C)C)cccn2)CC)CC1)=O
SPLASH splash10-0a6r-4920210000-610554a346afea212ffe
Source of Spectrum E1-39-3787-26
Wiley ID 1598977