Vitas-M small molecule compound

(4E)-5-(4-ethylphenyl)-4-(hydroxy{4-[(3-methylbenzyl)oxy]phenyl}methylidene)-1-(5-methyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione

Catalog ID
STK616998
SMILES CCc1ccc(cc1)C1N(c2nnc(s2)C)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCc1cccc(c1)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 C30H27N3O4S MW 525.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O4S/c1-4-20-8-10-22(11-9-20)26-25(28(35)29(36)33(26)30-32-31-19(3)38-30)27(34)23-12-14-24(15-13-23)37-17-21-7-5-6-18(2)16-21/h5-16,26,34H,4,17H2,1-3H3/b27-25+
InChIKey
PBPJTXSCKGITPX-IMVLJIQESA-N
Synonyms
839700-18-4
(4E)5(4ethylphenyl)4(hydroxy(4((3methylbenzyl)oxy)phenyl)methylidene)1(5methyl134thiadiazol2yl)pyrrolidine23dione
(4E)5(4ETHYLPHENYL)4(HYDROXY(4((3METHYLPHENYL)METHOXY)PHENYL)METHYLIDENE)1(5METHYL134THIADIAZOL2YL)PYRROLIDINE23DIONE
839700184
CCC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OCC4=CC=CC(=C4)C)O)C(=O)C(=O)N2C5=NN=C(S5)C
CCc1ccc(cc1)C1N(c2nnc(s2)C)C(=O)C(=O)C1=C(c1ccc(cc1)OCc1cccc(c1)C)O
InChI=1SC30H27N3O4Sc142081022(11920)2625(28(35)29(36)33(26)30323119(3)3830)27(34)23121424(151323)37172175618(2)1621h5162634H417H213H3b2725+
MFCD08730165
ZINC000102715859
ZINC000102715861

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Available files

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