Vitas-M small molecule compound
2-methoxy-4-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 2-methylbenzoate
Catalog ID
STK701966
SMILES COc1cc(ccc1OC(=O)c1ccccc1C)/C=C/1\SC(=S)N(C1=O)C(c1ccccc1)C
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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 C27H23NO4S2 MW 489.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23NO4S2/c1-17-9-7-8-12-21(17)26(30)32-22-14-13-19(15-23(22)31-3)16-24-25(29)28(27(33)34-24)18(2)20-10-5-4-6-11-20/h4-16,18H,1-3H3/b24-16-InChIKey
BYPGFEFBAAHEIA-JLPGSUDCSA-NSynonyms
374083-53-1(2METHOXY4((Z)(4OXO3(1PHENYLETHYL)2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)2METHYLBENZOATE
(Z)2methoxy4((4oxo3(1phenylethyl)2thioxothiazolidin5ylidene)methyl)phenyl2methylbenzoate
2methoxy4((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)phenyl2methylbenzoate
374083531
CC1=CC=CC=C1C(=O)OC2=C(C=C(C=C2)C=C3C(=O)N(C(=S)S3)C(C)C4=CC=CC=C4)OC
COc1cc(ccc1OC(=O)c1ccccc1C)C=C1SC(=S)N(C1=O)C(c1ccccc1)C
InChI=1SC27H23NO4S2c1179781221(17)26(30)3222141319(1523(22)313)162425(29)28(27(33)3424)18(2)20105461120h41618H13H3b2416
MFCD01949762
ZINC000002282331
ZINC000002282333
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