(2S)-3-methyl-2-[[(2S)-2-(3-methylbut-2-enylamino)-1-oxo-3-phenylpropyl]amino]-N-[(1S)-2-methyl-1-(2-thiazolyl)propyl]butanamide

SpectraBase Compound ID	K7OhIZNHzJv
InChI	InChI=1S/C26H38N4O2S/c1-17(2)12-13-27-21(16-20-10-8-7-9-11-20)24(31)29-22(18(3)4)25(32)30-23(19(5)6)26-28-14-15-33-26/h7-12,14-15,18-19,21-23,27H,13,16H2,1-6H3,(H,29,31)(H,30,32)/t21-,22-,23-/m0/s1
InChIKey	PFDHHCIJPOAOJM-VABKMULXSA-N Google Search
Mol Weight	470.7 g/mol
Molecular Formula	C26H38N4O2S
Exact Mass	470.271548 g/mol

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SpectraBase Spectrum ID	8TWeegXS1Kj
Name	(2S)-3-methyl-2-[[(2S)-2-(3-methylbut-2-enylamino)-1-oxo-3-phenylpropyl]amino]-N-[(1S)-2-methyl-1-(2-thiazolyl)propyl]butanamide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C26H38N4O2S
InChI	InChI=1S/C26H38N4O2S/c1-17(2)12-13-27-21(16-20-10-8-7-9-11-20)24(31)29-22(18(3)4)25(32)30-23(19(5)6)26-28-14-15-33-26/h7-12,14-15,18-19,21-23,27H,13,16H2,1-6H3,(H,29,31)(H,30,32)/t21-,22-,23-/m0/s1
InChIKey	PFDHHCIJPOAOJM-VABKMULXSA-N
Molecular Weight	470.676 g/mol
SMILES	N(C([C@@](NC([C@](Cc1ccccc1)(NCC=C(C)C)[H])=O)(C(C)C)[H])=O)[C@](c1nccs1)(C(C)C)[H]
SPLASH	splash10-0079-2900000000-46a71ba12b072781344c
Source of Spectrum	JA-50-337-0
Synonyms	(2S)-3-methyl-2-[[(2S)-2-(3-methylbut-2-enylamino)-3-phenyl-propanoyl]amino]-N-[(1S)-2-methyl-1-(1,3-thiazol-2-yl)propyl]butanamide (2S)-3-methyl-2-[[(2S)-2-(3-methylbut-2-enylamino)-3-phenyl-propanoyl]amino]-N-[(1S)-2-methyl-1-thiazol-2-yl-propyl]butanamide (2S)-3-methyl-2-[[(2S)-2-(3-methylbut-2-enylamino)-3-phenyl-propanoyl]amino]-N-[(1S)-2-methyl-1-thiazol-2-yl-propyl]butyramide
Wiley ID	1392837