Vitas-M small molecule compound

(2Z)-6-(2-chlorobenzyl)-2-[(2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK554036
SMILES COc1ccccc1/C=C/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1Cl

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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 C22H16ClN3O3S MW 437.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O3S/c1-29-18-11-5-3-7-14(18)9-6-12-19-21(28)26-22(30-19)24-20(27)17(25-26)13-15-8-2-4-10-16(15)23/h2-12H,13H2,1H3/b9-6+,19-12-
InChIKey
BWOPVGDPTXLRNR-MUFYDRSQSA-N
Synonyms
638134-70-0
(2Z)6((2CHLOROPHENYL)METHYL)2((E)3(2METHOXYPHENYL)PROP2ENYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6(2chlorobenzyl)2((2E)3(2methoxyphenyl)prop2en1ylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)6(2chlorobenzyl)2((E)3(2methoxyphenyl)allylidene)2Hthiazolo(32b)(124)triazine37dione
2((2E)3(2METHOXYPHENYL)PROP2ENYLIDENE)6((2CHLOROPHENYL)METHYL)13THIAZOLIDINO(32B)124TRIAZINE37DIONE
638134700
COC1=CC=CC=C1C=CC=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=CC=C4Cl)S2
COc1ccccc1C=CC=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1Cl
InChI=1SC22H16ClN3O3Sc129181153714(18)96121921(28)2622(3019)2420(27)17(2526)13158241016(15)23h212H13H21H3b96+1912
MFCD04005110
ZINC000001451321
ZINC01451321
ZINC1451321

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Available files

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