Vitas-M small molecule compound
methyl 4-[(Z)-(3,7-dioxo-6-phenyl-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene)methyl]benzoate
Catalog ID
STK801015
SMILES COC(=O)c1ccc(cc1)/C=c/1\sc2n(c1=O)nc(c(=O)n2)c1ccccc1
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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 C20H13N3O4S MW 391.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O4S/c1-27-19(26)14-9-7-12(8-10-14)11-15-18(25)23-20(28-15)21-17(24)16(22-23)13-5-3-2-4-6-13/h2-11H,1H3/b15-11-InChIKey
IMAZMOJOSKONPX-PTNGSMBKSA-NSynonyms
COC(=O)C1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)C4=CC=CC=C4)S2
COC(=O)c1ccc(cc1)C=c1sc2n(c1=O)nc(c(=O)n2)c1ccccc1
InChI=1SC20H13N3O4Sc12719(26)149712(81014)111518(25)2320(2815)2117(24)16(2223)135324613h211H1H3b1511
METHYL4((Z)(37DIOXO6PHENYL(13)THIAZOLO(32B)(124)TRIAZIN2YLIDENE)METHYL)BENZOATE
methyl4((Z)(37dioxo6phenyl7H(13)thiazolo(32b)(124)triazin2(3H)ylidene)methyl)benzoate
MFCD03533642
ZINC000016265407
ZINC16265407
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