Vitas-M small molecule compound
5'-(5-chloro-2-methoxyphenyl)-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
STL352013
SMILES COc1ccc(cc1N1C(=O)C2C(C1=O)C1(NC2C(C)C)c2nc3ccccc3c(=O)n2c2c1cccc2)Cl
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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 C30H25ClN4O4 MW 541.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClN4O4/c1-15(2)25-23-24(28(38)34(27(23)37)21-14-16(31)12-13-22(21)39-3)30(33-25)18-9-5-7-11-20(18)35-26(36)17-8-4-6-10-19(17)32-29(30)35/h4-15,23-25,33H,1-3H3InChIKey
KJRURLOAUUGBQC-UHFFFAOYSA-NSynonyms
(3aR6aS)5(5chloro2methoxyphenyl)3isopropyl33adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(5H6aH)trione
5(5chloro2methoxyphenyl)1propan2ylspiro(123a6atetrahydropyrrolo(34c)pyrrole36indolo(21b)quinazoline)4612trione
5(5chloro2methoxyphenyl)3(propan2yl)3a6adihydro2H12Hspiro(indolo(21b)quinazoline61pyrrolo(34c)pyrrole)4612(3H5H)trione
CC(C)C1C2C(C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)OC)C4(N1)C5=CC=CC=C5N6C4=NC7=CC=CC=C7C6=O
COc1ccc(cc1N1C(=O)(C@@H)2(C@H)(C1=O)C1(NC2C(C)C)c2nc3ccccc3c(=O)n2c2c1cccc2)Cl
InChI=1SC30H25ClN4O4c115(2)252324(28(38)34(27(23)37)211416(31)121322(21)393)30(3325)189571120(18)3526(36)178461019(17)3229(30)35h415232533H13H3
MFCD28032469
ZINC000101359845
ZINC000245310750
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.