Vitas-M small molecule compound

(3a'S,6a'R)-5'-(4-acetylphenyl)-3'-(1H-indol-3-ylmethyl)-6,7-dimethyl-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
STL531701
SMILES CC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C1(NC2Cc2c[nH]c3c2cccc3)C(=O)Nc2c1ccc(c2C)C

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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 C32H28N4O4 MW 532.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N4O4/c1-16-8-13-23-28(17(16)2)34-31(40)32(23)27-26(25(35-32)14-20-15-33-24-7-5-4-6-22(20)24)29(38)36(30(27)39)21-11-9-19(10-12-21)18(3)37/h4-13,15,25-27,33,35H,14H2,1-3H3,(H,34,40)/t25?,26-,27+,32?/m1/s1
InChIKey
ADFLRTWCVUDHAX-XKOGGIFOSA-N
Synonyms
956813-65-3
(3~(a)~(R)6~(a)~(S))5(4acetylphenyl)1(1~(H)indol3ylmethyl)67dimethylspiro(123~(a)6~(a)tetrahydropyrrolo(34c)pyrrole331~(H)indole)246trione
(3aS6aR)3((1Hindol3yl)methyl)5(4acetylphenyl)67dimethyl33adihydro2Hspiro(indoline31pyrrolo(34c)pyrrole)246(5H6aH)trione
(3aS6aR)5(4acetylphenyl)3(1Hindol3ylmethyl)67dimethyl3a6adihydro2Hspiro(indole31pyrrolo(34c)pyrrole)246(1H3H5H)trione
16403709
956813653
CC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C1(NC2Cc2c(nH)c3c2cccc3)C(=O)Nc2c1ccc(c2C)C
InChI=1SC32H28N4O4c1168132328(17(16)2)3431(40)32(23)2726(25(3532)1420153324754622(20)24)29(38)36(30(27)39)2111919(101221)18(3)37h4131525273335H14H213H3(H3440)t25?2627+32?m1s1
MFCD06765045
ZINC000070699208
ZINC000070699216

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Available files

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