Vitas-M small molecule compound
4-{(Z)-[4-oxo-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}phenyl 3-chloro-1-benzothiophene-2-carboxylate
Catalog ID
STK821788
SMILES S=C1S/C(=C\c2ccc(cc2)OC(=O)c2sc3c(c2Cl)cccc3)/C(=O)N1C(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 C27H18ClNO3S3 MW 536.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClNO3S3/c1-16(18-7-3-2-4-8-18)29-25(30)22(35-27(29)33)15-17-11-13-19(14-12-17)32-26(31)24-23(28)20-9-5-6-10-21(20)34-24/h2-16H,1H3/b22-15-InChIKey
DWOWEWOCXXTAMY-JCMHNJIXSA-NSynonyms
(4((Z)(4oxo3(1phenylethyl)2sulfanylidene13thiazolidin5ylidene)methyl)phenyl)3chloro1benzothiophene2carboxylate
4((Z)(4oxo3(1phenylethyl)2thioxo13thiazolidin5ylidene)methyl)phenyl3chloro1benzothiophene2carboxylate
CC(C1=CC=CC=C1)N2C(=O)C(=CC3=CC=C(C=C3)OC(=O)C4=C(C5=CC=CC=C5S4)Cl)SC2=S
InChI=1SC27H18ClNO3S3c116(187324818)2925(30)22(3527(29)33)1517111319(141217)3226(31)2423(28)209561021(20)3424h216H1H3b2215
MFCD03463014
S=C1SC(=Cc2ccc(cc2)OC(=O)c2sc3c(c2Cl)cccc3)C(=O)N1C(c1ccccc1)C
ZINC000097946979
ZINC000097946980
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