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Pyrimidine, hexahydro-2-(1-methylethyl)-1-[(4-methylphenyl)sulfonyl]-3-[2-(1-piperidinyl)acetyl]-
SpectraBase Compound ID AEglqxO5bTQ
InChI InChI=1S/C21H33N3O3S/c1-17(2)21-23(20(25)16-22-12-5-4-6-13-22)14-7-15-24(21)28(26,27)19-10-8-18(3)9-11-19/h8-11,17,21H,4-7,12-16H2,1-3H3
InChIKey QWMOTHREDGSTJF-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C21H33N3O3S
Exact Mass 407.224263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9FsvKyQB2l
Name Pyrimidine, hexahydro-2-(1-methylethyl)-1-[(4-methylphenyl)sulfonyl]-3-[2-(1-piperidinyl)acetyl]-
Alternate Name(s) 1-[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-2-(1-piperidinyl)ethanone 1-[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-2-piperidin-1-ylethanone 1-[2-isopropyl-3-(p-tolylsulfonyl)hexahydropyrimidin-1-yl]-2-(1-piperidyl)ethanone 1-[3-(4-methylphenyl)sulfonyl-2-propan-2-yl-1,3-diazinan-1-yl]-2-piperidin-1-yl-ethanone
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Formula C21H33N3O3S
InChI InChI=1S/C21H33N3O3S/c1-17(2)21-23(20(25)16-22-12-5-4-6-13-22)14-7-15-24(21)28(26,27)19-10-8-18(3)9-11-19/h8-11,17,21H,4-7,12-16H2,1-3H3
InChIKey QWMOTHREDGSTJF-UHFFFAOYSA-N
Molecular Weight 407.573 g/mol
SMILES C1CN(C(N(C1)S(=O)(=O)c1ccc(cc1)C)C(C)C)C(=O)CN1CCCCC1
SPLASH splash10-0002-9000000000-6d691ce56c10b99f1b8e
Source of Spectrum IY-1-4590-7
Wiley ID 1653890