Vitas-M small molecule compound
methyl 5'-amino-6'-cyano-2'-methyl-2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
Catalog ID
STK782339
SMILES C#CCN1c2ccccc2C2(C1=O)C(=C(N)Oc1c2sc(c1C(=O)OC)C)C#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 C21H15N3O4S MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O4S/c1-4-9-24-14-8-6-5-7-12(14)21(20(24)26)13(10-22)18(23)28-16-15(19(25)27-3)11(2)29-17(16)21/h1,5-8H,9,23H2,2-3H3InChIKey
RQYWKZGOKLRQJK-UHFFFAOYSA-NSynonyms
CC1=C(C2=C(S1)C3(C4=CC=CC=C4N(C3=O)CC#C)C(=C(O2)N)C#N)C(=O)OC
InChI=1SC21H15N3O4Sc1492414865712(14)21(20(24)26)13(1022)18(23)281615(19(25)273)11(2)2917(16)21h158H923H223H3
METHYL5AMINO6CYANO2METHYL11OXO10PROP2YNYLSPIRO(7HTHIOPHENO(32B)PYRAN73INDOLINE)3CARBOXYLATE
methyl5amino6cyano2methyl2oxo1(prop2yn1yl)12dihydrospiro(indole37thieno(32b)pyran)3carboxylate
METHYL5AMINO6CYANO2METHYL2OXO1PROP2YNYLSPIRO(INDOLE37THIENO(32B)PYRAN)3CARBOXYLATE
MFCD06017444
ZINC000004728120
ZINC000004728122
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