Vitas-M small molecule compound
3-{[1-(3,4-dichlorobenzyl)-1H-1,2,4-triazol-3-yl]amino}-6,7-dimethoxy-2-benzofuran-1(3H)-one
Catalog ID
STL175092
SMILES COc1c(OC)ccc2c1C(=O)OC2Nc1ncn(n1)Cc1ccc(c(c1)Cl)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 C19H16Cl2N4O4 MW 435.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16Cl2N4O4/c1-27-14-6-4-11-15(16(14)28-2)18(26)29-17(11)23-19-22-9-25(24-19)8-10-3-5-12(20)13(21)7-10/h3-7,9,17H,8H2,1-2H3,(H,23,24)InChIKey
YFXVWHXCZMLBIG-UHFFFAOYSA-NSynonyms
938021-83-13((1((34DICHLOROPHENYL)METHYL)(124TRIAZOL3YL))AMINO)67DIMETHOXY3HYDROISOBENZOFURAN1ONE
3((1((34dichlorophenyl)methyl)124triazol3yl)amino)67dimethoxy3H2benzofuran1one
3((1(34dichlorobenzyl)1H124triazol3yl)amino)67dimethoxy2benzofuran1(3H)one
938021831
COC1=C(C2=C(C=C1)C(OC2=O)NC3=NN(C=N3)CC4=CC(=C(C=C4)Cl)Cl)OC
InChI=1SC19H16Cl2N4O4c12714641115(16(14)282)18(26)2917(11)231922925(2419)8103512(20)13(21)710h37917H8H212H3(H2324)
MFCD08557946
ZINC000020606598
ZINC000020606599
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