Vitas-M small molecule compound
(3R)-2,2-dimethyl-N-[(2S)-1-(4-methylpiperazin-1-yl)-1-oxopropan-2-yl]-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Catalog ID
STK590359
SMILES CN1CCN(CC1)C(=O)[C@@H](NC(=O)[C@H]1N2C(SC1(C)C)c1c(C2=O)cccc1)C
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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 C21H28N4O3S MW 416.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N4O3S/c1-13(18(27)24-11-9-23(4)10-12-24)22-17(26)16-21(2,3)29-20-15-8-6-5-7-14(15)19(28)25(16)20/h5-8,13,16,20H,9-12H2,1-4H3,(H,22,26)/t13-,16+,20?/m0/s1InChIKey
GSLOJYAAXKNBLS-DAHSEZPTSA-NSynonyms
1173681-20-3(3R)22dimethylN((2S)1(4methylpiperazin1yl)1oxopropan2yl)5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethylN((2S)1(4methylpiperazin1yl)1oxopropan2yl)5oxo39bdihydro(13)thiazolo(23a)isoindole3carboxamide
(3R)22dimethylN((S)1(4methylpiperazin1yl)1oxopropan2yl)5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
1173681203
CC(C(=O)N1CCN(CC1)C)NC(=O)C2C(SC3N2C(=O)C4=CC=CC=C34)(C)C
CN1CCN(CC1)C(=O)(C@@H)(NC(=O)(C@H)1N2C(SC1(C)C)c1c(C2=O)cccc1)C
InChI=1SC21H28N4O3Sc113(18(27)2411923(4)101224)2217(26)1621(23)292015865714(15)19(28)25(16)20h58131620H912H214H3(H2226)t1316+20?m0s1
ZINC000020533543
ZINC000020533544
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