Vitas-M small molecule compound

(6Z)-3-(3,4-dimethoxyphenyl)-6-(4-ethoxy-3-methoxybenzylidene)[1,3]thiazolo[2,3-c][1,2,4]triazol-5(6H)-one

Catalog ID
STK795736
SMILES CCOc1ccc(cc1OC)/C=c/1\sc2n(c1=O)c(nn2)c1ccc(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 C22H21N3O5S MW 439.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5S/c1-5-30-16-8-6-13(10-17(16)28-3)11-19-21(26)25-20(23-24-22(25)31-19)14-7-9-15(27-2)18(12-14)29-4/h6-12H,5H2,1-4H3/b19-11-
InChIKey
UPZCGDJMSZMSDR-ODLFYWEKSA-N
Synonyms

(6Z)3(34DIMETHOXYPHENYL)6((4ETHOXY3METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(23C)(124)TRIAZOL5ONE
(6Z)3(34dimethoxyphenyl)6(4ethoxy3methoxybenzylidene)(13)thiazolo(23c)(124)triazol5(6H)one
CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NN=C3S2)C4=CC(=C(C=C4)OC)OC)OC
CCOc1ccc(cc1OC)C=c1sc2n(c1=O)c(nn2)c1ccc(c(c1)OC)OC
InChI=1SC22H21N3O5Sc1530168613(1017(16)283)111921(26)2520(232422(25)3119)147915(272)18(1214)294h612H5H214H3b1911
MFCD05855582
ZINC000012412035
ZINC12412035

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Available files

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