Vitas-M small molecule compound
4-[(Z)-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-chloro-6-methyl-1-benzothiophene-2-carboxylate
Catalog ID
STK821722
SMILES Cc1ccc2c(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 C27H18ClNO3S3 MW 536.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClNO3S3/c1-16-7-12-20-21(13-16)34-24(23(20)28)26(31)32-19-10-8-17(9-11-19)14-22-25(30)29(27(33)35-22)15-18-5-3-2-4-6-18/h2-14H,15H2,1H3/b22-14-InChIKey
YFLDYHFCOMNQRP-HMAPJEAMSA-NSynonyms
(4((Z)(3benzyl4oxo2sulfanylidene13thiazolidin5ylidene)methyl)phenyl)3chloro6methyl1benzothiophene2carboxylate
4((Z)(3benzyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl3chloro6methyl1benzothiophene2carboxylate
CC1=CC2=C(C=C1)C(=C(S2)C(=O)OC3=CC=C(C=C3)C=C4C(=O)N(C(=S)S4)CC5=CC=CC=C5)Cl
Cc1ccc2c(c1)sc(c2Cl)C(=O)Oc1ccc(cc1)C=C1SC(=S)N(C1=O)Cc1ccccc1
InChI=1SC27H18ClNO3S3c1167122021(1316)3424(23(20)28)26(31)321910817(91119)142225(30)29(27(33)3522)15185324618h214H15H21H3b2214
MFCD03464565
ZINC000097946958
ZINC97946958
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