Vitas-M small molecule compound
(1S,3S)-2,2-dicyano-3-(3,4-dimethoxyphenyl)cyclopropanecarboxamide
Catalog ID
STK785319
SMILES N#CC1(C#N)[C@@H]([C@@H]1C(=O)N)c1ccc(c(c1)OC)OC
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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 C14H13N3O3 MW 271.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N3O3/c1-19-9-4-3-8(5-10(9)20-2)11-12(13(17)18)14(11,6-15)7-16/h3-5,11-12H,1-2H3,(H2,17,18)/t11-,12-/m1/s1InChIKey
KMNXAZZVZJGUGB-VXGBXAGGSA-NSynonyms
(1S3S)22DICYANO3(34DIMETHOXYPHENYL)CYCLOPROPANE1CARBOXAMIDE
(1S3S)22dicyano3(34dimethoxyphenyl)cyclopropanecarboxamide
COC1=C(C=C(C=C1)C2C(C2(C#N)C#N)C(=O)N)OC
InChI=1SC14H13N3O3c1199438(510(9)202)1112(13(17)18)14(11615)716h351112H12H3(H21718)t1112m1s1
N#CC1(C#N)(C@@H)((C@@H)1C(=O)N)c1ccc(c(c1)OC)OC
ZINC000004779398
ZINC04779398
ZINC4779398
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