Vitas-M small molecule compound

(3a'S,6a'R)-7-chloro-5'-(4-fluorophenyl)-3'-(1H-indol-3-ylmethyl)-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
STK575739
SMILES Fc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)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 C28H20ClFN4O3 MW 514.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClFN4O3/c29-19-6-3-5-18-24(19)32-27(37)28(18)23-22(25(35)34(26(23)36)16-10-8-15(30)9-11-16)21(33-28)12-14-13-31-20-7-2-1-4-17(14)20/h1-11,13,21-23,31,33H,12H2,(H,32,37)/t21?,22-,23+,28?/m1/s1
InChIKey
TVVHSPVHRUUGGH-PHZBOBDISA-N
Synonyms
1013754-86-3
(3aR6aS)7chloro5(4fluorophenyl)1(1Hindol3ylmethyl)spiro(123a6atetrahydropyrrolo(34c)pyrrole331Hindole)246trione
(3aS6aR)3((1Hindol3yl)methyl)7chloro5(4fluorophenyl)33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)7chloro5(4fluorophenyl)3(1Hindol3ylmethyl)3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
1013754863
C1=CC=C2C(=C1)C(=CN2)CC3C4C(C(=O)N(C4=O)C5=CC=C(C=C5)F)C6(N3)C7=C(C(=CC=C7)Cl)NC6=O
Fc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1cccc2Cl
InChI=1SC28H20ClFN4O3c29196351824(19)3227(37)28(18)2322(25(35)34(26(23)36)1610815(30)91116)21(3328)1214133120721417(14)20h1111321233133H12H2(H3237)t21?2223+28?m1s1
MFCD07641142
ZINC000015971895
ZINC000020572263

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Available files

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