Vitas-M small molecule compound
2-methoxy-4-[(Z)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl 3-chloro-6-methyl-1-benzothiophene-2-carboxylate
Catalog ID
STK820779
SMILES COc1cc(ccc1OC(=O)c1sc2c(c1Cl)ccc(c2)C)/C=C/1\SC(=S)N(C1=O)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 C22H16ClNO4S3 MW 490.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClNO4S3/c1-11-4-6-13-16(8-11)30-19(18(13)23)21(26)28-14-7-5-12(9-15(14)27-3)10-17-20(25)24(2)22(29)31-17/h4-10H,1-3H3/b17-10-InChIKey
SKORUAQWKZTZBH-YVLHZVERSA-NSynonyms
372973-25-6(2METHOXY4((Z)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)3CHLORO6METHYL1BENZOTHIOPHENE2CARBOXYLATE
(Z)2methoxy4((3methyl4oxo2thioxothiazolidin5ylidene)methyl)phenyl3chloro6methylbenzo(b)thiophene2carboxylate
2methoxy4((Z)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenyl3chloro6methyl1benzothiophene2carboxylate
372973256
CC1=CC2=C(C=C1)C(=C(S2)C(=O)OC3=C(C=C(C=C3)C=C4C(=O)N(C(=S)S4)C)OC)Cl
COc1cc(ccc1OC(=O)c1sc2c(c1Cl)ccc(c2)C)C=C1SC(=S)N(C1=O)C
InChI=1SC22H16ClNO4S3c111461316(811)3019(18(13)23)21(26)28147512(915(14)273)101720(25)24(2)22(29)3117h410H13H3b1710
MFCD01458088
ZINC000002286538
ZINC02286538
ZINC2286538
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