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N-[2-[6-(4-phenylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl]benzamide
SpectraBase Compound ID 2R0xeZYr6wZ
InChI InChI=1S/C29H21N5OS/c35-28(23-11-5-2-6-12-23)30-25-14-8-7-13-24(25)27-31-32-29-34(27)33-26(19-36-29)22-17-15-21(16-18-22)20-9-3-1-4-10-20/h1-18H,19H2,(H,30,35)
InChIKey LBPBHCKHPWIWDM-UHFFFAOYSA-N
Mol Weight 487.58 g/mol
Molecular Formula C29H21N5OS
Exact Mass 487.146681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JthIIOB9Hft
Name N-[2-[6-(4-phenylphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-3-yl]phenyl]benzamide
CAS Registry Number 106346-32-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H21N5OS
InChI InChI=1S/C29H21N5OS/c35-28(23-11-5-2-6-12-23)30-25-14-8-7-13-24(25)27-31-32-29-34(27)33-26(19-36-29)22-17-15-21(16-18-22)20-9-3-1-4-10-20/h1-18H,19H2,(H,30,35)
InChIKey LBPBHCKHPWIWDM-UHFFFAOYSA-N
Molecular Weight 487.581 g/mol
SMILES N(C(=O)c1ccccc1)c1c(-c2[n]3N=C(c4ccc(cc4)-c4ccccc4)CSc3nn2)cccc1
SPLASH splash10-0a4i-3900200000-7eacf8a58d308443c544
Source of Spectrum Y-23-47-6
Wiley ID 1396720