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2H-1,3-Benzimidazol-2-one, 1,3-dihydro-1,3-dimethyl-5-nitro-6-[4-(propylsulfonyl)-1-piperazinyl]-
SpectraBase Compound ID 83Q7y9pHtJ5
InChI InChI=1S/C16H23N5O5S/c1-4-9-27(25,26)20-7-5-19(6-8-20)14-10-12-13(11-15(14)21(23)24)18(3)16(22)17(12)2/h10-11H,4-9H2,1-3H3
InChIKey UWKUQWQIEGGGGB-UHFFFAOYSA-N
Mol Weight 397.45 g/mol
Molecular Formula C16H23N5O5S
Exact Mass 397.14199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCNXURMO37f
Name 2H-1,3-Benzimidazol-2-one, 1,3-dihydro-1,3-dimethyl-5-nitro-6-[4-(propylsulfonyl)-1-piperazinyl]-
Alternate Name(s) 1,3-Dimethyl-5-nitro-6-(4-propylsulfonyl-1-piperazinyl)-2-benzimidazolone 1,3-Dimethyl-5-nitro-6-(4-propylsulfonylpiperazin-1-yl)benzimidazol-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23N5O5S
InChI InChI=1S/C16H23N5O5S/c1-4-9-27(25,26)20-7-5-19(6-8-20)14-10-12-13(11-15(14)21(23)24)18(3)16(22)17(12)2/h10-11H,4-9H2,1-3H3
InChIKey UWKUQWQIEGGGGB-UHFFFAOYSA-N
Molecular Weight 397.450 g/mol
SMILES CCCS(N1CCN(c2c(N(=O)=O)cc3N(C)C(N(c3c2)C)=O)CC1)(=O)=O
SPLASH splash10-0udl-5690000000-0241793885f701fe1539
Source of Spectrum IY-1-4528-9
Wiley ID 1653272