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Pyrimidine, hexahydro-2-(1-methylethyl)-1-[(4-methylphenyl)sulfonyl]-3-[2-(1-pyrrolidinyl)acetyl]-
SpectraBase Compound ID 9CTHjdB6LCr
InChI InChI=1S/C20H31N3O3S/c1-16(2)20-22(19(24)15-21-11-4-5-12-21)13-6-14-23(20)27(25,26)18-9-7-17(3)8-10-18/h7-10,16,20H,4-6,11-15H2,1-3H3
InChIKey RQMNCAUPZMNFEV-UHFFFAOYSA-N
Mol Weight 393.55 g/mol
Molecular Formula C20H31N3O3S
Exact Mass 393.208613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JgIsP50JYE9
Name Pyrimidine, hexahydro-2-(1-methylethyl)-1-[(4-methylphenyl)sulfonyl]-3-[2-(1-pyrrolidinyl)acetyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H31N3O3S
InChI InChI=1S/C20H31N3O3S/c1-16(2)20-22(19(24)15-21-11-4-5-12-21)13-6-14-23(20)27(25,26)18-9-7-17(3)8-10-18/h7-10,16,20H,4-6,11-15H2,1-3H3
InChIKey RQMNCAUPZMNFEV-UHFFFAOYSA-N
Molecular Weight 393.546 g/mol
SMILES C1CN(C(N(C1)S(=O)(=O)c1ccc(cc1)C)C(C)C)C(=O)CN1CCCC1
SPLASH splash10-001i-9000000000-a0e10a09f7e8f1e533d5
Source of Spectrum IY-1-4675-1
Synonyms 1-[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-2-(1-pyrrolidinyl)ethanone 1-[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-2-pyrrolidin-1-ylethanone 1-[2-isopropyl-3-(p-tolylsulfonyl)hexahydropyrimidin-1-yl]-2-pyrrolidin-1-yl-ethanone 1-[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-2-pyrrolidin-1-yl-ethanone
Wiley ID 1654734