Vitas-M small molecule compound
(4E)-5-(3-bromophenyl)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-2,3-dione
Catalog ID
STL049249
SMILES COc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)Br)/C(=C(/c2ccc(c(c2)C)OC)\O)/C(=O)C1=O
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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 C27H21BrN2O5S MW 565.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21BrN2O5S/c1-14-11-16(7-10-20(14)35-3)24(31)22-23(15-5-4-6-17(28)12-15)30(26(33)25(22)32)27-29-19-9-8-18(34-2)13-21(19)36-27/h4-13,23,31H,1-3H3/b24-22+InChIKey
DPMWTKALXRFBKJ-ZNTNEXAZSA-NSynonyms
(4E)5(3bromophenyl)4(hydroxy(4methoxy3methylphenyl)methylidene)1(6methoxy13benzothiazol2yl)pyrrolidine23dione
5(3BROMOPHENYL)3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)4((4METHOXY3METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)OC)C5=CC(=CC=C5)Br)O)OC
COc1ccc2c(c1)sc(n2)N1C(c2cccc(c2)Br)C(=C(c2ccc(c(c2)C)OC)O)C(=O)C1=O
InChI=1SC27H21BrN2O5Sc1141116(71020(14)353)24(31)2223(1554617(28)1215)30(26(33)25(22)32)2729199818(342)1321(19)3627h4132331H13H3b2422+
MFCD05730244
ZINC000102884847
ZINC000102884850
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