Vitas-M small molecule compound

(3a'S,6a'R)-7-chloro-5'-(4-methoxybenzyl)-3'-(propan-2-yl)-3a',6a'-dihydro-2'H-spiro[indole-3,1'-pyrrolo[3,4-c]pyrrole]-2,4',6'(1H,3'H,5'H)-trione

Catalog ID
STL531678
SMILES COc1ccc(cc1)CN1C(=O)[C@H]2[C@@H](C1=O)C1(NC2C(C)C)C(=O)Nc2c1cccc2Cl

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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 C24H24ClN3O4 MW 453.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN3O4/c1-12(2)19-17-18(24(27-19)15-5-4-6-16(25)20(15)26-23(24)31)22(30)28(21(17)29)11-13-7-9-14(32-3)10-8-13/h4-10,12,17-19,27H,11H2,1-3H3,(H,26,31)/t17-,18-,19?,24?/m0/s1
InChIKey
AVFBUDDCGRBDQG-BBFQFKIHSA-N
Synonyms
956824-27-4
(3~(a)~(R)6~(a)~(S))7chloro5((4methoxyphenyl)methyl)1propan2ylspiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)7chloro3isopropyl5(4methoxybenzyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)7chloro5(4methoxybenzyl)3(propan2yl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16402706
956824274
COc1ccc(cc1)CN1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2C(C)C)C(=O)Nc2c1cccc2Cl
InChI=1SC24H24ClN3O4c112(2)191718(24(2719)1554616(25)20(15)2623(24)31)22(30)28(21(17)29)11137914(323)10813h41012171927H11H213H3(H2631)t171819?24?m0s1
MFCD06494210
ZINC000015957771
ZINC000020611100

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Available files

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