Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methoxy-3-methylphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-phenylpyrrolidine-2,3-dione
Catalog ID
STK605648
SMILES COc1ccc(cc1C)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1)c1nc2c(s1)cc(cc2)C)/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 C27H22N2O4S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S/c1-15-9-11-19-21(13-15)34-27(28-19)29-23(17-7-5-4-6-8-17)22(25(31)26(29)32)24(30)18-10-12-20(33-3)16(2)14-18/h4-14,23,30H,1-3H3/b24-22+InChIKey
UNBJJUXYLQVESC-ZNTNEXAZSA-NSynonyms
618416-59-4(4E)4(hydroxy(4methoxy3methylphenyl)methylidene)1(6methyl13benzothiazol2yl)5phenylpyrrolidine23dione
3HYDROXY4((4METHOXY3METHYLPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)5PHENYL3PYRROLIN2ONE
618416594
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC(=C(C=C4)OC)C)O)C(=O)C3=O)C5=CC=CC=C5
COc1ccc(cc1C)C(=C1C(=O)C(=O)N(C1c1ccccc1)c1nc2c(s1)cc(cc2)C)O
InChI=1SC27H22N2O4Sc1159111921(1315)3427(2819)2923(177546817)22(25(31)26(29)32)24(30)18101220(333)16(2)1418h4142330H13H3b2422+
MFCD08735152
ZINC000102699320
ZINC000102699329
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