Vitas-M small molecule compound
ethyl 5'-amino-6'-cyano-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
Catalog ID
STK782307
SMILES CCOC(=O)c1c(C)sc2c1OC(=C(C12C(=O)Nc2c1cccc2)C#N)N
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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 C19H15N3O4S MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O4S/c1-3-25-17(23)13-9(2)27-15-14(13)26-16(21)11(8-20)19(15)10-6-4-5-7-12(10)22-18(19)24/h4-7H,3,21H2,1-2H3,(H,22,24)InChIKey
MNJAPSDADMKGSG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1OC(=C(C23C4=CC=CC=C4NC3=O)C#N)N)C
ethyl5amino6cyano2methyl2oxo12dihydrospiro(indole37thieno(32b)pyran)3carboxylate
ETHYL5AMINO6CYANO2METHYL2OXOSPIRO(1HINDOLE37THIENO(32B)PYRAN)3CARBOXYLATE
InChI=1SC19H15N3O4Sc132517(23)139(2)271514(13)2616(21)11(820)19(15)10645712(10)2218(19)24h47H321H212H3(H2224)
MFCD06017388
ZINC000004728083
ZINC000004728084
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