Vitas-M small molecule compound
3-[(3S,3'S,3a'R,6a'S)-2,4',6'-trioxo-5'-(prop-2-en-1-yl)-1,2,3',3a',4',5',6',6a'-octahydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrol]-3'-yl]propanamide
Catalog ID
STL531361
SMILES C=CCN1C(=O)[C@@H]2[C@H](C1=O)[C@@]1(N[C@H]2CCC(=O)N)C(=O)Nc2c1cccc2
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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 C19H20N4O4 MW 368.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4/c1-2-9-23-16(25)14-12(7-8-13(20)24)22-19(15(14)17(23)26)10-5-3-4-6-11(10)21-18(19)27/h2-6,12,14-15,22H,1,7-9H2,(H2,20,24)(H,21,27)/t12-,14-,15+,19+/m0/s1InChIKey
JGTYMOHQNZJJJV-JLMZAJLHSA-NSynonyms
956276-23-611876973
3((1~(S)3~(S)3~(a)~(S)6~(a)~(R))246trioxo5prop2enylspiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)propanamide
3((1S3S3aR6aS)5allyl246trioxo33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)propanamide
3((3S3S3aR6aS)246trioxo5(prop2en1yl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)propanamide
956276236
C=CCN1C(=O)(C@@H)2(C@H)(C1=O)(C@@)1(N(C@H)2CCC(=O)N)C(=O)Nc2c1cccc2
InChI=1SC19H20N4O4c1292316(25)1412(7813(20)24)2219(15(14)17(23)26)10534611(10)2118(19)27h2612141522H179H2(H22024)(H2127)t121415+19+m0s1
MFCD07637714
ZINC000100783012
ZINC100783012
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