Vitas-M small molecule compound

6,7-dimethoxy-3-{[1-(3-methylbenzyl)-1H-1,2,4-triazol-3-yl]amino}-2-benzofuran-1(3H)-one

Catalog ID
STL175088
SMILES COc1c(OC)ccc2c1C(=O)OC2Nc1ncn(n1)Cc1cccc(c1)C

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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 C20H20N4O4 MW 380.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4/c1-12-5-4-6-13(9-12)10-24-11-21-20(23-24)22-18-14-7-8-15(26-2)17(27-3)16(14)19(25)28-18/h4-9,11,18H,10H2,1-3H3,(H,22,23)
InChIKey
VOTDYYFAUFCALZ-UHFFFAOYSA-N
Synonyms
938011-85-9
67DIMETHOXY3((1((3METHYLPHENYL)METHYL)(124TRIAZOL3YL))AMINO)3HYDROISOBENZOFURAN1ONE
67dimethoxy3((1((3methylphenyl)methyl)124triazol3yl)amino)3H2benzofuran1one
67dimethoxy3((1(3methylbenzyl)1H124triazol3yl)amino)2benzofuran1(3H)one
938011859
CC1=CC(=CC=C1)CN2C=NC(=N2)NC3C4=C(C(=C(C=C4)OC)OC)C(=O)O3
InChI=1SC20H20N4O4c11254613(912)1024112120(2324)2218147815(262)17(273)16(14)19(25)2818h491118H10H213H3(H2223)
MFCD08557584
ZINC000020606542
ZINC000020606544

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Available files

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