Vitas-M small molecule compound

5'-[2-chloro-5-(trifluoromethyl)phenyl]-3'-(propan-2-yl)-3a',6a'-dihydro-2'H,12H-spiro[indolo[2,1-b]quinazoline-6,1'-pyrrolo[3,4-c]pyrrole]-4',6',12(3'H,5'H)-trione

Catalog ID
STL351900
SMILES CC(C1NC2(C3C1C(=O)N(C3=O)c1cc(ccc1Cl)C(F)(F)F)c1nc3ccccc3c(=O)n1c1c2cccc1)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 C30H22ClF3N4O3 MW 578.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22ClF3N4O3/c1-14(2)24-22-23(27(41)37(26(22)40)21-13-15(30(32,33)34)11-12-18(21)31)29(36-24)17-8-4-6-10-20(17)38-25(39)16-7-3-5-9-19(16)35-28(29)38/h3-14,22-24,36H,1-2H3
InChIKey
WRMFJFZIIJJBEM-UHFFFAOYSA-N
Synonyms

(3aR6aS)5(2chloro5(trifluoromethyl)phenyl)3isopropyl33adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(5H6aH)trione
5(2chloro5(trifluoromethyl)phenyl)1propan2ylspiro(123a6atetrahydropyrrolo(34c)pyrrole36indolo(21b)quinazoline)4612trione
5(2chloro5(trifluoromethyl)phenyl)3(propan2yl)3a6adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(3H5H)trione
CC(C)C1C2C(C(=O)N(C2=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)C4(N1)C5=CC=CC=C5N6C4=NC7=CC=CC=C7C6=O
CC(C1NC2((C@@H)3(C@H)1C(=O)N(C3=O)c1cc(ccc1Cl)C(F)(F)F)c1nc3ccccc3c(=O)n1c1c2cccc1)C
InChI=1SC30H22ClF3N4O3c114(2)242223(27(41)37(26(22)40)211315(30(3233)34)111218(21)31)29(3624)178461020(17)3825(39)16735919(16)3528(29)38h314222436H12H3
MFCD28032455
ZINC000101602285
ZINC000245312637

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Available files

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