Vitas-M small molecule compound

ethyl 4-(5-{(Z)-[6-oxo-2-(3,4,5-trimethoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]methyl}furan-2-yl)benzoate

Catalog ID
STK799817
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=c/1\sc2n(c1=O)nc(n2)c1cc(OC)c(c(c1)OC)OC

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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 C27H23N3O7S MW 533.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O7S/c1-5-36-26(32)16-8-6-15(7-9-16)19-11-10-18(37-19)14-22-25(31)30-27(38-22)28-24(29-30)17-12-20(33-2)23(35-4)21(13-17)34-3/h6-14H,5H2,1-4H3/b22-14-
InChIKey
IAHMZQUZPLVUQP-HMAPJEAMSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)N4C(=NC(=N4)C5=CC(=C(C(=C5)OC)OC)OC)S3
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=c1sc2n(c1=O)nc(n2)c1cc(OC)c(c(c1)OC)OC
ethyl4(5((Z)(6oxo2(345trimethoxyphenyl)(13)thiazolo(32b)(124)triazol5(6H)ylidene)methyl)furan2yl)benzoate
ETHYL4(5((Z)(6OXO2(345TRIMETHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL5YLIDENE)METHYL)FURAN2YL)BENZOATE
InChI=1SC27H23N3O7Sc153626(32)168615(7916)19111018(3719)142225(31)3027(3822)2824(2930)171220(332)23(354)21(1317)343h614H5H214H3b2214
MFCD06285233
ZINC000098046596
ZINC98046596

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Available files

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