Vitas-M small molecule compound

(2Z)-2-(3,4-dichlorobenzylidene)-6-(3,4-dimethoxybenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK553758
SMILES COc1ccc(cc1OC)Cc1nn2c(nc1=O)s/c(=C\c1ccc(c(c1)Cl)Cl)/c2=O

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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 C21H15Cl2N3O4S MW 476.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15Cl2N3O4S/c1-29-16-6-4-12(9-17(16)30-2)8-15-19(27)24-21-26(25-15)20(28)18(31-21)10-11-3-5-13(22)14(23)7-11/h3-7,9-10H,8H2,1-2H3/b18-10-
InChIKey
RMUCLZOFOIHQHC-ZDLGFXPLSA-N
Synonyms
638133-67-2
(2Z)2((34DICHLOROPHENYL)METHYLIDENE)6((34DIMETHOXYPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)2(34dichlorobenzylidene)6(34dimethoxybenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(34dichlorobenzylidene)6(34dimethoxybenzyl)2Hthiazolo(32b)(124)triazine37dione
2((34DICHLOROPHENYL)METHYLENE)6((34DIMETHOXYPHENYL)METHYL)13THIAZOLIDINO(32B)124TRIAZINE37DIONE
638133672
COC1=C(C=C(C=C1)CC2=NN3C(=O)C(=CC4=CC(=C(C=C4)Cl)Cl)SC3=NC2=O)OC
COc1ccc(cc1OC)Cc1nn2c(nc1=O)sc(=Cc1ccc(c(c1)Cl)Cl)c2=O
InChI=1SC21H15Cl2N3O4Sc129166412(917(16)302)81519(27)242126(2515)20(28)18(3121)10113513(22)14(23)711h37910H8H212H3b1810
MFCD04004702
ZINC000001450217
ZINC01450217
ZINC1450217

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.