Vitas-M small molecule compound
(3R)-N-[(2S)-1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-methyl-1-oxobutan-2-yl]-2,2-dimethyl-5-oxo-2,3,5,9b-tetrahydro[1,3]thiazolo[2,3-a]isoindole-3-carboxamide
Catalog ID
STL531373
SMILES COc1cc(CCNC(=O)[C@H](C(C)C)NC(=O)[C@H]2N3C(SC2(C)C)c2c(C3=O)cccc2)ccc1OC
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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 C28H35N3O5S MW 525.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N3O5S/c1-16(2)22(24(32)29-14-13-17-11-12-20(35-5)21(15-17)36-6)30-25(33)23-28(3,4)37-27-19-10-8-7-9-18(19)26(34)31(23)27/h7-12,15-16,22-23,27H,13-14H2,1-6H3,(H,29,32)(H,30,33)/t22-,23+,27?/m0/s1InChIKey
RPWSMDLNHWKKQC-FOCHENRBSA-NSynonyms
956197-36-7(3R)N((2S)1((2(34dimethoxyphenyl)ethyl)amino)3methyl1oxobutan2yl)22dimethyl5oxo2359btetrahydro(13)thiazolo(23a)isoindole3carboxamide
(3R)N((S)1((34dimethoxyphenethyl)amino)3methyl1oxobutan2yl)22dimethyl5oxo2359btetrahydrothiazolo(23a)isoindole3carboxamide
956197367
COc1cc(CCNC(=O)(C@H)(C(C)C)NC(=O)(C@H)2N3C(SC2(C)C)c2c(C3=O)cccc2)ccc1OC
ZINC000008876201
ZINC000012888662
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