Vitas-M small molecule compound

2-hydroxy-9-methoxy-3-{[(E)-(3-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

Catalog ID
STK566637
SMILES COc1cccc2c1c1nc(O)n(c(=O)c1[nH]2)/N=C/c1cccc(c1)[N+](=O)[O-]

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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 C18H13N5O5 MW 379.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O5/c1-28-13-7-3-6-12-14(13)15-16(20-12)17(24)22(18(25)21-15)19-9-10-4-2-5-11(8-10)23(26)27/h2-9,20H,1H3,(H,21,25)/b19-9+
InChIKey
GBSRKDOARUPNSI-DJKKODMXSA-N
Synonyms
674306-18-4
2hydroxy9methoxy3(((E)(3nitrophenyl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
674306184
9METHOXY3((E)(3NITROPHENYL)METHYLIDENEAMINO)15DIHYDROPYRIMIDO(54B)INDOLE24DIONE
COC1=CC=CC2=C1C3=C(N2)C(=O)N(C(=O)N3)N=CC4=CC(=CC=C4)(N+)(=O)(O)
COc1cccc2c1c1nc(O)n(c(=O)c1(nH)2)N=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC18H13N5O5c128137361214(13)1516(2012)17(24)22(18(25)2115)1991042511(810)23(26)27h2920H1H3(H2125)b199+
MFCD04081593
ZINC000017197617
ZINC33408654

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Available files

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