Vitas-M small molecule compound

2-[(3a'S,6a'R)-5-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
STL529595
SMILES NC(=O)CC1NC2([C@H]3[C@@H]1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(Cl)cc1

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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/c24-13-6-7-15-14(10-13)23(22(32)26-15)19-18(16(27-23)11-17(25)29)20(30)28(21(19)31)9-8-12-4-2-1-3-5-12/h1-7,10,16,18-19,27H,8-9,11H2,(H2,25,29)(H,26,32)/t16?,18-,19+,23?/m1/s1
InChIKey
ARFUMZSKJWYODQ-PBHGZRDXSA-N
Synonyms
956824-87-6
16404086
2((3~(a)~(R)6~(a)~(S))5chloro246trioxo5(2phenylethyl)spiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)1yl)acetamide
2((3aS6aR)5chloro246trioxo5(2phenylethyl)1233a4566aoctahydro2Hspiro(indole31pyrrolo(34c)pyrrol)3yl)acetamide
2((3aS6aR)5chloro246trioxo5phenethyl33a4566ahexahydro2Hspiro(indoline31pyrrolo(34c)pyrrol)3yl)acetamide
956824876
InChI=1SC23H21ClN4O4c2413671514(1013)23(22(32)2615)1918(16(2723)1117(25)29)20(30)28(21(19)31)98124213512h171016181927H8911H2(H22529)(H2632)t16?1819+23?m1s1
MFCD06766095
NC(=O)CC1NC2((C@H)3(C@@H)1C(=O)N(C3=O)CCc1ccccc1)C(=O)Nc1c2cc(Cl)cc1
ZINC000015959917
ZINC000015959920

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Available files

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