Vitas-M small molecule compound

(3R)-N-[(1S)-2-{[(2S)-1-hydroxy-3-methylbutan-2-yl]amino}-2-oxo-1-phenylethyl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide

Catalog ID
STL008227
SMILES OC[C@H](C(C)C)NC(=O)[C@H](c1ccccc1)NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H31N3O4S MW 481.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N3O4S/c1-15(2)19(14-30)27-22(31)20(16-10-6-5-7-11-16)28-23(32)21-26(3,4)34-25-18-13-9-8-12-17(18)24(33)29(21)25/h5-13,15,19-21,25,30H,14H2,1-4H3,(H,27,31)(H,28,32)/t19-,20+,21-,25?/m1/s1
InChIKey
RHGUVQREZFOAFQ-UQJRMYRASA-N
Synonyms
956996-63-7
(3R)N((1S)2(((2S)1hydroxy3methylbutan2yl)amino)2oxo1phenylethyl)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((1S)2(((2S)1hydroxy3methylbutan2yl)amino)2oxo1phenylethyl)22dimethyl5oxo39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)2(((S)1hydroxy3methylbutan2yl)amino)2oxo1phenylethyl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
956996637
CC(C)C(CO)NC(=O)C(C1=CC=CC=C1)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
InChI=1SC26H31N3O4Sc115(2)19(1430)2722(31)20(16106571116)2823(32)2126(34)34251813981217(18)24(33)29(21)25h5131519212530H14H214H3(H2731)(H2832)t1920+2125?m1s1
MFCD07637927
OC(C@H)(C(C)C)NC(=O)(C@H)(c1ccccc1)NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1
ZINC000008876847
ZINC000008876849

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Available files

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