Vitas-M small molecule compound

(3R)-N-[(2S)-1-(cyclopropylamino)-1-oxo-3-phenylpropan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide

Catalog ID
STL008413
SMILES O=C([C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)NC1CC1

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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 C25H27N3O3S MW 449.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3S/c1-25(2)20(28-23(31)17-10-6-7-11-18(17)24(28)32-25)22(30)27-19(21(29)26-16-12-13-16)14-15-8-4-3-5-9-15/h3-11,16,19-20,24H,12-14H2,1-2H3,(H,26,29)(H,27,30)/t19-,20+,24?/m0/s1
InChIKey
CVJLRYXZBFUFFQ-ZPVKFHTISA-N
Synonyms
956996-73-9
(3R)N((2S)1(cyclopropylamino)1oxo3phenylpropan2yl)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((2S)1(cyclopropylamino)1oxo3phenylpropan2yl)22dimethyl5oxo39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)1(cyclopropylamino)1oxo3phenylpropan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
956996739
CC1(C(N2C(S1)C3=CC=CC=C3C2=O)C(=O)NC(CC4=CC=CC=C4)C(=O)NC5CC5)C
InChI=1SC25H27N3O3Sc125(2)20(2823(31)1710671118(17)24(28)3225)22(30)2719(21(29)2616121316)14158435915h31116192024H1214H212H3(H2629)(H2730)t1920+24?m0s1
MFCD07637934
O=C((C@@H)(NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)Cc1ccccc1)NC1CC1
ZINC000012890247
ZINC000012890258

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Available files

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