Vitas-M small molecule compound
6-[5-(3,5-dichlorophenyl)furan-2-yl]-3-(4-methoxybenzyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STL111979
SMILES COc1ccc(cc1)Cc1nnc2n1N=C(CS2)c1ccc(o1)c1cc(Cl)cc(c1)Cl
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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 C22H16Cl2N4O2S MW 471.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16Cl2N4O2S/c1-29-17-4-2-13(3-5-17)8-21-25-26-22-28(21)27-18(12-31-22)20-7-6-19(30-20)14-9-15(23)11-16(24)10-14/h2-7,9-11H,8,12H2,1H3InChIKey
AFMNICNLHALJPY-UHFFFAOYSA-NSynonyms
1((6(5(35DICHLOROPHENYL)(2FURYL))(7H124TRIAZOLO(34B)134THIADIAZIN3YL))METHYL)4METHOXYBENZENE
6(5(35DICHLOROPHENYL)FURAN2YL)3((4METHOXYPHENYL)METHYL)7H(124)TRIAZOLO(34B)(134)THIADIAZINE
6(5(35dichlorophenyl)furan2yl)3(4methoxybenzyl)7H(124)triazolo(34b)(134)thiadiazine
COC1=CC=C(C=C1)CC2=NN=C3N2N=C(CS3)C4=CC=C(O4)C5=CC(=CC(=C5)Cl)Cl
InChI=1SC22H16Cl2N4O2Sc129174213(3517)82125262228(21)2718(123122)207619(3020)14915(23)1116(24)1014h27911H812H21H3
MFCD05827324
ZINC000012645818
ZINC12645818
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