Vitas-M small molecule compound
butyl 2-amino-7,7-dimethyl-2',5-dioxo-1'-(prop-2-en-1-yl)-1',2',5,6,7,8-hexahydrospiro[chromene-4,3'-indole]-3-carboxylate
Catalog ID
STK729736
SMILES CCCCOC(=O)C1=C(N)OC2=C(C31C(=O)N(c1c3cccc1)CC=C)C(=O)CC(C2)(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 C26H30N2O5 MW 450.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N2O5/c1-5-7-13-32-23(30)21-22(27)33-19-15-25(3,4)14-18(29)20(19)26(21)16-10-8-9-11-17(16)28(12-6-2)24(26)31/h6,8-11H,2,5,7,12-15,27H2,1,3-4H3InChIKey
HKZQNJRYLXAYTE-UHFFFAOYSA-NSynonyms
(S)butyl1allyl2amino77dimethyl25dioxo5678tetrahydrospiro(chromene43indoline)3carboxylate
butyl2amino77dimethyl25dioxo1(prop2en1yl)125678hexahydrospiro(chromene43indole)3carboxylate
BUTYL2AMINO77DIMETHYL25DIOXO1PROP2ENYLSPIRO(68DIHYDROCHROMENE43INDOLE)3CARBOXYLATE
CCCCOC(=O)C1=C(N)OC2=C((C@@)31C(=O)N(c1c3cccc1)CC=C)C(=O)CC(C2)(C)C
CCCCOC(=O)C1=C(OC2=C(C13C4=CC=CC=C4N(C3=O)CC=C)C(=O)CC(C2)(C)C)N
InChI=1SC26H30N2O5c157133223(30)2122(27)33191525(34)1418(29)20(19)26(21)1610891117(16)28(1262)24(26)31h6811H257121527H2134H3
MFCD07205108
ZINC000009088683
ZINC000009695167
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