Vitas-M small molecule compound
propan-2-yl 5'-cyano-2'-methyl-6'-sulfanyl-1',4'-dihydro-3,4'-bipyridine-3'-carboxylate
Catalog ID
STK968353
SMILES N#CC1=C(S)NC(=C(C1c1cccnc1)C(=O)OC(C)C)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 C16H17N3O2S MW 315.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O2S/c1-9(2)21-16(20)13-10(3)19-15(22)12(7-17)14(13)11-5-4-6-18-8-11/h4-6,8-9,14,19,22H,1-3H3InChIKey
WSYNPNAVOLJYKP-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)S)C#N)C2=CN=CC=C2)C(=O)OC(C)C
InChI=1SC16H17N3O2Sc19(2)2116(20)1310(3)1915(22)12(717)14(13)1154618811h4689141922H13H3
METHYLETHYL5CYANO2METHYL4(3PYRIDYL)6SULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
MFCD01450542
PROPAN2YL5CYANO2METHYL4PYRIDIN3YL6SULFANYL14DIHYDROPYRIDINE3CARBOXYLATE
propan2yl5cyano2methyl6sulfanyl14dihydro34bipyridine3carboxylate
ZINC000000496088
ZINC000020814092
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