Vitas-M small molecule compound
2-({2-iodo-6-methoxy-4-[(Z)-{(2E)-2-[(4-methoxyphenyl)imino]-3-methyl-4-oxo-1,3-thiazolidin-5-ylidene}methyl]phenoxy}methyl)benzonitrile
Catalog ID
STL374769
SMILES COc1ccc(cc1)/N=C\1/S/C(=C\c2cc(I)c(c(c2)OC)OCc2ccccc2C#N)/C(=O)N1C
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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 C27H22IN3O4S MW 611.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22IN3O4S/c1-31-26(32)24(36-27(31)30-20-8-10-21(33-2)11-9-20)14-17-12-22(28)25(23(13-17)34-3)35-16-19-7-5-4-6-18(19)15-29/h4-14H,16H2,1-3H3/b24-14-,30-27+InChIKey
XSEIHBJCFAEYMZ-BXBQQLAMSA-NSynonyms
2((2iodo6methoxy4((Z)((2E)2((4methoxyphenyl)imino)3methyl4oxo13thiazolidin5ylidene)methyl)phenoxy)methyl)benzonitrile
COc1ccc(cc1)N=C1SC(=Cc2cc(I)c(c(c2)OC)OCc2ccccc2C#N)C(=O)N1C
MFCD02954784
ZINC000008451873
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