Vitas-M small molecule compound
4-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3,6-dichloro-1-benzothiophene-2-carboxylate
Catalog ID
STK821727
SMILES Clc1ccc2c(c1)sc(c2Cl)C(=O)Oc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)Cc1ccccc1
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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 C26H15Cl2NO3S3 MW 556.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H15Cl2NO3S3/c27-17-8-11-19-20(13-17)34-23(22(19)28)25(31)32-18-9-6-15(7-10-18)12-21-24(30)29(26(33)35-21)14-16-4-2-1-3-5-16/h1-13H,14H2/b21-12-InChIKey
RXRQLLMAIJZCLL-MTJSOVHGSA-NSynonyms
(4((Z)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenyl)36dichloro1benzothiophene2carboxylate
4((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl36dichloro1benzothiophene2carboxylate
C1=CC=C(C=C1)CN2C(=O)C(=CC3=CC=C(C=C3)OC(=O)C4=C(C5=C(S4)C=C(C=C5)Cl)Cl)SC2=S
Clc1ccc2c(c1)sc(c2Cl)C(=O)Oc1ccc(cc1)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC26H15Cl2NO3S3c27178111920(1317)3423(22(19)28)25(31)32189615(71018)122124(30)29(26(33)3521)14164213516h113H14H2b2112
MFCD03462974
ZINC000097946959
ZINC97946959
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