ethanediamide, N~1~-[4-(2-benzothiazolyl)phenyl]-N~2~-[(1S)-2-hydroxy-1-(phenylmethyl)ethyl]-

SpectraBase Compound ID	ErYVUlV9X26
InChI	InChI=1S/C24H21N3O3S/c28-15-19(14-16-6-2-1-3-7-16)26-23(30)22(29)25-18-12-10-17(11-13-18)24-27-20-8-4-5-9-21(20)31-24/h1-13,19,28H,14-15H2,(H,25,29)(H,26,30)
InChIKey	FZQVVYZYQSOFLE-UHFFFAOYSA-N Google Search
Mol Weight	431.51 g/mol
Molecular Formula	C24H21N3O3S
Exact Mass	431.130363 g/mol

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SpectraBase Spectrum ID	7NfgeVVTFEj
Name	Ethanediamide, N~1~-[4-(2-benzothiazolyl)phenyl]-N~2~-[(1S)-2-hydroxy-1-(phenylmethyl)ethyl]-
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	431.130362719 u
Formula	C24H21N3O3S
InChI	InChI=1S/C24H21N3O3S/c28-15-19(14-16-6-2-1-3-7-16)26-23(30)22(29)25-18-12-10-17(11-13-18)24-27-20-8-4-5-9-21(20)31-24/h1-13,19,28H,14-15H2,(H,25,29)(H,26,30)
InChIKey	FZQVVYZYQSOFLE-UHFFFAOYSA-N
Molecular Weight	431.510 g/mol
SMILES	N(C(C(NC(CO)CC1=CC=CC=C1)=O)=O)C1=CC=C(C2=NC=3C=CC=CC3S2)C=C1