Vitas-M small molecule compound
(4E)-5-(4-ethoxy-3-methoxyphenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL052872
SMILES CCOc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC
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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 C30H28N2O5S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O5S/c1-5-18-9-13-21-24(15-18)38-30(31-21)32-26(20-12-14-22(37-6-2)23(16-20)36-4)25(28(34)29(32)35)27(33)19-10-7-17(3)8-11-19/h7-16,26,33H,5-6H2,1-4H3/b27-25+InChIKey
MWKCKCAFSYPJDM-IMVLJIQESA-NSynonyms
618420-27-2(4E)5(4ethoxy3methoxyphenyl)1(6ethyl13benzothiazol2yl)4(hydroxy(4methylphenyl)methylidene)pyrrolidine23dione
5(4ETHOXY3METHOXYPHENYL)1(6ETHYLBENZOTHIAZOL2YL)3HYDROXY4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
618420272
CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)C)O)C(=O)C3=O)C5=CC(=C(C=C5)OCC)OC
CCOc1ccc(cc1OC)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1sc2c(n1)ccc(c2)CC
InChI=1SC30H28N2O5Sc15189132124(1518)3830(3121)3226(20121422(3762)23(1620)364)25(28(34)29(32)35)27(33)1910717(3)81119h7162633H56H214H3b2725+
MFCD05731702
ZINC000102890776
ZINC000102890778
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