Vitas-M small molecule compound

(2E)-2-(4-chlorobenzylidene)-6-(4-methylbenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione

Catalog ID
STK823913
SMILES Cc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C/c1ccc(cc1)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 C20H14ClN3O2S MW 395.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClN3O2S/c1-12-2-4-13(5-3-12)10-16-18(25)22-20-24(23-16)19(26)17(27-20)11-14-6-8-15(21)9-7-14/h2-9,11H,10H2,1H3/b17-11+
InChIKey
XHIDMVZMVDLWNG-GZTJUZNOSA-N
Synonyms

(2E)2((4chlorophenyl)methylidene)6((4methylphenyl)methyl)(13)thiazolo(32b)(124)triazine37dione
(2E)2(4chlorobenzylidene)6(4methylbenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
CC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=C(C=C4)Cl)SC3=NC2=O
Cc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1ccc(cc1)Cl)c2=O
InChI=1SC20H14ClN3O2Sc1122413(5312)101618(25)222024(2316)19(26)17(2720)11146815(21)9714h2911H10H21H3b1711+
MFCD06290976
ZINC000005006667
ZINC05006667
ZINC5006667

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Available files

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