Vitas-M small molecule compound
ethyl (1'S,2'S,3R,3a'R)-2-oxo-2'-[(4-propylphenyl)carbonyl]-1,1',2,2'-tetrahydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate
Catalog ID
STL528045
SMILES CCOC(=O)[C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccc(cc1)CCC)C(=O)Nc1c2cccc1
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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 C32H30N2O4 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O4/c1-3-9-20-14-16-22(17-15-20)29(35)27-28(30(36)38-4-2)34-25-13-8-5-10-21(25)18-19-26(34)32(27)23-11-6-7-12-24(23)33-31(32)37/h5-8,10-19,26-28H,3-4,9H2,1-2H3,(H,33,37)/t26-,27+,28+,32-/m1/s1InChIKey
CNFKUIICOBGJAV-QODLHPCFSA-NSynonyms
1212462-58-2(1S2S3R3aR)ethyl2oxo2(4propylbenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinoline)1carboxylate
1212462582
16398758
CCOC(=O)(C@H)1N2c3ccccc3C=C(C@@H)2(C@)2((C@@H)1C(=O)c1ccc(cc1)CCC)C(=O)Nc1c2cccc1
ethyl(1~(S)2~(S)3~(R)3~(a)~(R))2oxo2(4propylbenzoyl)spiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)1carboxylate
ethyl(1S2S3R3aR)2oxo2((4propylphenyl)carbonyl)1122tetrahydro3aHspiro(indole33pyrrolo(12a)quinoline)1carboxylate
InChI=1SC32H30N2O4c13920141622(171520)29(35)2728(30(36)3842)342513851021(25)181926(34)32(27)2311671224(23)3331(32)37h5810192628H349H212H3(H3337)t2627+28+32m1s1
MFCD03851628
ZINC000070680619
ZINC70680619
Check stock
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Check stock on Vitas-MAvailable files
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