Vitas-M small molecule compound
(2E)-6-benzyl-2-(2,4-dimethoxybenzylidene)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK814881
SMILES COc1cc(OC)ccc1/C=c\1/sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1
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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 C21H17N3O4S MW 407.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O4S/c1-27-15-9-8-14(17(12-15)28-2)11-18-20(26)24-21(29-18)22-19(25)16(23-24)10-13-6-4-3-5-7-13/h3-9,11-12H,10H2,1-2H3/b18-11+InChIKey
ITJZSCLNZMJTTK-WOJGMQOQSA-NSynonyms
(2E)6BENZYL2((24DIMETHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2E)6benzyl2(24dimethoxybenzylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
COC1=CC(=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=CC=C4)S2)OC
COc1cc(OC)ccc1C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1
InChI=1SC21H17N3O4Sc127159814(17(1215)282)111820(26)2421(2918)2219(25)16(2324)10136435713h391112H10H212H3b1811+
MFCD04442374
ZINC000002533704
ZINC02533704
ZINC2533704
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