Vitas-M small molecule compound
3'-propan-2-yl 5'-prop-2-en-1-yl 2'-amino-5-bromo-6'-methyl-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3',5'-dicarboxylate
Catalog ID
STK790988
SMILES C=CCOC(=O)C1=C(C)OC(=C(C21C(=O)Nc1c2cc(Br)cc1)C(=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 C21H21BrN2O6 MW 477.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN2O6/c1-5-8-28-18(25)15-11(4)30-17(23)16(19(26)29-10(2)3)21(15)13-9-12(22)6-7-14(13)24-20(21)27/h5-7,9-10H,1,8,23H2,2-4H3,(H,24,27)InChIKey
ZJQDPVZUDKDTEF-UHFFFAOYSA-NSynonyms
371200-42-9371200429
3OPROPAN2YL5OPROP2ENYL2AMINO5BROMO6METHYL2OXOSPIRO(1HINDOLE34PYRAN)35DICARBOXYLATE
3propan2yl5prop2en1yl2amino5bromo6methyl2oxo12dihydrospiro(indole34pyran)35dicarboxylate
5allyl3isopropyl2amino5bromo6methyl2oxospiro(indoline34pyran)35dicarboxylate
CC1=C(C2(C3=C(C=CC(=C3)Br)NC2=O)C(=C(O1)N)C(=O)OC(C)C)C(=O)OCC=C
InChI=1SC21H21BrN2O6c1582818(25)1511(4)3017(23)16(19(26)2910(2)3)21(15)13912(22)6714(13)2420(21)27h57910H1823H224H3(H2427)
MFCD01564279
ZINC000009034164
ZINC000009034165
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