Vitas-M small molecule compound

(3a'R,6a'S)-5'-(2-fluorophenyl)-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
STL569923
SMILES CC(C1NC2([C@@H]3[C@H]1C(=O)N(C3=O)c1ccccc1F)c1ccccc1n1c2nc2ccccc2c1=O)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 C29H23FN4O3 MW 494.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23FN4O3/c1-15(2)24-22-23(27(37)33(26(22)36)21-14-8-5-11-18(21)30)29(32-24)17-10-4-7-13-20(17)34-25(35)16-9-3-6-12-19(16)31-28(29)34/h3-15,22-24,32H,1-2H3/t22-,23-,24?,29?/m1/s1
InChIKey
VNOWCQLTELBJEK-HYJHSRQPSA-N
Synonyms
1177522-65-4
(3aR6aS)5(2fluorophenyl)3(propan2yl)3a6adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(3H5H)trione
(3aR6aS)5(2fluorophenyl)3isopropyl33adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(5H6aH)trione
(3aS6aR)5(2fluorophenyl)1propan2ylspiro(123a6atetrahydropyrrolo(34c)pyrrole36indolo(21b)quinazoline)4612trione
1177522654
17599352
CC(C1NC2((C@@H)3(C@H)1C(=O)N(C3=O)c1ccccc1F)c1ccccc1n1c2nc2ccccc2c1=O)C
InChI=1SC29H23FN4O3c115(2)242223(27(37)33(26(22)36)2114851118(21)30)29(3224)1710471320(17)3425(35)169361219(16)3128(29)34h315222432H12H3t222324?29?m1s1
ZINC000013719824
ZINC000013719833

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Available files

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