2,5-Anhydro-6-{[(3-chlorophenyl)carbamoyl]amino}-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-D-galactitol

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Systematic / IUPAC Name: 1-(3-Chlorophenyl)-3-[[(2R,3R,4S,5S)-4-hydroxy-5-(hydroxymethyl)-3-(4-phenylpiperazin-1-yl)oxolan-2-yl]methyl]urea

ID: Reference9502

Other Names: D-Galactitol, 2,5-anhydro-6-[[[(3-chlorophenyl)amino]carbonyl]amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-;
NAT27-401049

Formula: C23H29ClN4O4

Spectral Data

2,5-Anhydro-6-{[(3-chlorophenyl)carbamoyl]amino}-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-D-galactitol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1922
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 3/19/2020 6:32:52 AM
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Identificators

InChI InChI=1S/C23H29ClN4O4/c24-16-5-4-6-17(13-16)26-23(31)25-14-19-21(22(30)20(15-29)32-19)28-11-9-27(10-12-28)18-7-2-1-3-8-18/h1-8,13,19-22,29-30H,9-12,14-15H2,(H2,25,26,31)/t19-,20+,21+,22-/m1/s1
InChI Key ZRXVAWHNKIJZHP-CLAROIROSA-N
Canonical SMILES C1CN(CCN1C2C(OC(C2O)CO)CNC(=O)NC3=CC(=CC=C3)Cl)C4=CC=CC=C4
CAS
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Other Names D-Galactitol, 2,5-anhydro-6-[[[(3-chlorophenyl)amino]carbonyl]amino]-4,6-dideoxy-4-(4-phenyl-1-piperazinyl)-;
NAT27-401049

In Other Databases

PubChem 28961385
ChemSpider 22807051