Vitas-M small molecule compound

8-methyl-3-{[(E)-(4-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one

Catalog ID
STK528983
SMILES Cc1ccc2c(c1)c1ncn(c(=O)c1[nH]2)/N=C/c1ccc(cc1)[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 C18H13N5O3 MW 347.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O3/c1-11-2-7-15-14(8-11)16-17(21-15)18(24)22(10-19-16)20-9-12-3-5-13(6-4-12)23(25)26/h2-10,21H,1H3/b20-9+
InChIKey
GUSYTVZAZQINHJ-AWQFTUOYSA-N
Synonyms
371945-07-2
(E)8methyl3((4nitrobenzylidene)amino)3Hpyrimido(54b)indol4(5H)one
371945072
8methyl3(((E)(4nitrophenyl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
8methyl3((E)(4nitrophenyl)methylideneamino)5Hpyrimido(54b)indol4one
CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)N=CC4=CC=C(C=C4)(N+)(=O)(O)
Cc1ccc2c(c1)c1ncn(c(=O)c1(nH)2)N=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H13N5O3c111271514(811)1617(2115)18(24)22(101916)209123513(6412)23(25)26h21021H1H3b209+
MFCD01856326
ZINC000000499697
ZINC33319410

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Available files

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