Vitas-M small molecule compound

9-(morpholin-4-yl)-1'-(naphthalen-1-yl)-8-nitro-1,2,4,4a-tetrahydro-2'H,6H-spiro[1,4-oxazino[4,3-a]quinoline-5,5'-pyrimidine]-2',4',6'(1'H,3'H)-trione

Catalog ID
STK682905
SMILES O=C1NC(=O)C2(C(=O)N1c1cccc3c1cccc3)Cc1cc([N+](=O)[O-])c(cc1N1C2COCC1)N1CCOCC1

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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 C29H27N5O7 MW 557.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O7/c35-26-29(27(36)33(28(37)30-26)21-7-3-5-18-4-1-2-6-20(18)21)16-19-14-24(34(38)39)23(31-8-11-40-12-9-31)15-22(19)32-10-13-41-17-25(29)32/h1-7,14-15,25H,8-13,16-17H2,(H,30,35,37)
InChIKey
KPVDIQMEAITLNG-UHFFFAOYSA-N
Synonyms

9(morpholin4yl)1(naphthalen1yl)8nitro1244atetrahydro2H6Hspiro(14oxazino(43a)quinoline55pyrimidine)246(1H3H)trione
9morpholin4yl1naphthalen1yl8nitrospiro(13diazinane55244a6tetrahydro1H(14)oxazino(43a)quinoline)246trione
C1COCCN1C2=C(C=C3CC4(C5COCCN5C3=C2)C(=O)NC(=O)N(C4=O)C6=CC=CC7=CC=CC=C76)(N+)(=O)(O)
InChI=1SC29H27N5O7c352629(27(36)33(28(37)3026)2173518412620(18)21)16191424(34(38)39)23(318114012931)1522(19)321013411725(29)32h17141525H8131617H2(H303537)
MFCD04061231
O=C1NC(=O)C2(C(=O)N1c1cccc3c1cccc3)Cc1cc((N+)(=O)(O))c(cc1N1C2COCC1)N1CCOCC1
ZINC000098005897
ZINC000245255678

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Available files

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