Vitas-M small molecule compound
2-[(3a'S,6a'R)-7-chloro-2,4',6'-trioxo-5'-(2-phenylethyl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]acetamide
Catalog ID
STL531845
SMILES NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1Cl
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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 C23H21ClN4O4 MW 452.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O4/c24-14-8-4-7-13-19(14)26-22(32)23(13)18-17(15(27-23)11-16(25)29)20(30)28(21(18)31)10-9-12-5-2-1-3-6-12/h1-8,15,17-18,27H,9-11H2,(H2,25,29)(H,26,32)/t15?,17-,18+,23?/m1/s1InChIKey
FOXOTUJWTVHLJC-IBBBCHJRSA-NSynonyms
957000-15-616404482
2((3~(a)~(R)6~(a)~(S))7chloro246trioxo5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)acetamide
2((3aS6aR)7chloro246trioxo5(2phenylethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
2((3aS6aR)7chloro246trioxo5phenethyl33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
957000156
InChI=1SC23H21ClN4O4c24148471319(14)2622(32)23(13)1817(15(2723)1116(25)29)20(30)28(21(18)31)109125213612h1815171827H911H2(H22529)(H2632)t15?1718+23?m1s1
MFCD06767221
NC(=O)CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cccc1Cl
ZINC000015968242
ZINC000015968248
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