tert-Butyl[(diphenylmethylene)amino](2-{[(4-methylphenyl)sulfonyl]- amino}cyclohexyl) acetate

SpectraBase Compound ID	CKJCvfwPzh6
InChI	InChI=1S/C32H38N2O4S/c1-23-19-21-26(22-20-23)39(36,37)34-28-18-12-11-17-27(28)30(31(35)38-32(2,3)4)33-29(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-10,13-16,19-22,27-28,30,34H,11-12,17-18H2,1-4H3/t27-,28-,30-/m0/s1
InChIKey	FIXKXDXUSBVKHR-XEVVZDEMSA-N Google Search
Mol Weight	546.7 g/mol
Molecular Formula	C32H38N2O4S
Exact Mass	546.255229 g/mol

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SpectraBase Spectrum ID	Hti1HsiORy2
Name	tert-Butyl[(diphenylmethylene)amino](2-{[(4-methylphenyl)sulfonyl]- amino}cyclohexyl) acetate
Alternate Name(s)	(S)-tert-butyl 2-((diphenylmethylene)amino)-2-((1R,2S)-2-(4-methylphenylsulfonamido)cyclohexyl)acetate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C32H38N2O4S
InChI	InChI=1S/C32H38N2O4S/c1-23-19-21-26(22-20-23)39(36,37)34-28-18-12-11-17-27(28)30(31(35)38-32(2,3)4)33-29(24-13-7-5-8-14-24)25-15-9-6-10-16-25/h5-10,13-16,19-22,27-28,30,34H,11-12,17-18H2,1-4H3/t27-,28-,30-/m0/s1
InChIKey	FIXKXDXUSBVKHR-XEVVZDEMSA-N
Literature Reference DOI	10.1021/ol7015302
Molecular Weight	546.726 g/mol
SMILES	N([C@]1(CCCC[C@@]1([C@]([H])(N=C(c1ccccc1)c1ccccc1)C(=O)OC(C)(C)C)[H])[H])S(c1ccc(cc1)C)(=O)=O
SPLASH	splash10-05di-2906200000-ac90e85887f16f89d970
Source of Spectrum	A1-9-4677/SM9-3j
Wiley ID	1758861