Vitas-M small molecule compound
(2E)-1-(3-amino-4H-1,2,4-triazol-4-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK416101
SMILES COc1cc(/C=C/C(=O)n2cnnc2N)ccc1OC
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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 C13H14N4O3 MW 274.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O3/c1-19-10-5-3-9(7-11(10)20-2)4-6-12(18)17-8-15-16-13(17)14/h3-8H,1-2H3,(H2,14,16)/b6-4+InChIKey
OGPSLGDMJIMNLR-GQCTYLIASA-NSynonyms
(2E)1(3AMINO(124TRIAZOL4YL))3(34DIMETHOXYPHENYL)PROP2EN1ONE
(2E)1(3amino4H124triazol4yl)3(34dimethoxyphenyl)prop2en1one
(E)1(3AMINO124TRIAZOL4YL)3(34DIMETHOXYPHENYL)PROP2EN1ONE
COC1=C(C=C(C=C1)C=CC(=O)N2C=NN=C2N)OC
COc1cc(C=CC(=O)n2cnnc2N)ccc1OC
InChI=1SC13H14N4O3c11910539(711(10)202)4612(18)178151613(17)14h38H12H3(H21416)b64+
MFCD04059008
ZINC000006490730
ZINC06490730
ZINC6490730
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