Vitas-M small molecule compound
7-methoxy-3-{[(E)-(4-nitrophenyl)methylidene]amino}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL056598
SMILES COc1ccc2c(c1)[nH]c1c2ncn(c1=O)/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 C18H13N5O4 MW 363.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N5O4/c1-27-13-6-7-14-15(8-13)21-17-16(14)19-10-22(18(17)24)20-9-11-2-4-12(5-3-11)23(25)26/h2-10,21H,1H3/b20-9+InChIKey
YWQDHFHSCVRQBD-AWQFTUOYSA-NSynonyms
714246-40-9(E)7methoxy3((4nitrobenzylidene)amino)3Hpyrimido(54b)indol4(5H)one
714246409
7methoxy3(((E)(4nitrophenyl)methylidene)amino)35dihydro4Hpyrimido(54b)indol4one
7METHOXY3((E)(4NITROPHENYL)METHYLIDENEAMINO)5HPYRIMIDO(54B)INDOL4ONE
COC1=CC2=C(C=C1)C3=C(N2)C(=O)N(C=N3)N=CC4=CC=C(C=C4)(N+)(=O)(O)
COc1ccc2c(c1)(nH)c1c2ncn(c1=O)N=Cc1ccc(cc1)(N+)(=O)(O)
InChI=1SC18H13N5O4c12713671415(813)211716(14)191022(18(17)24)209112412(5311)23(25)26h21021H1H3b209+
MFCD04007148
ZINC000005099974
ZINC33335097
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