Vitas-M small molecule compound
1-ethyl-1'-(2-methyl-5-nitrophenyl)-2,5'-dioxo-2'-(1H-pyrrol-1-yl)-1,2,5',6',7',8'-hexahydro-1'H-spiro[indole-3,4'-quinoline]-3'-carbonitrile
Catalog ID
STK783061
SMILES N#CC1=C(n2cccc2)N(c2cc(ccc2C)[N+](=O)[O-])C2=C(C31C(=O)N(c1c3cccc1)CC)C(=O)CCC2
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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 C30H25N5O4 MW 519.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O4/c1-3-33-23-10-5-4-9-21(23)30(29(33)37)22(18-31)28(32-15-6-7-16-32)34(24-11-8-12-26(36)27(24)30)25-17-20(35(38)39)14-13-19(25)2/h4-7,9-10,13-17H,3,8,11-12H2,1-2H3InChIKey
ACWKTFVQPWSACH-UHFFFAOYSA-NSynonyms
1ethyl1(2methyl5nitrophenyl)25dioxo2(1Hpyrrol1yl)125678hexahydro1Hspiro(indole34quinoline)3carbonitrile
1ETHYL1(2METHYL5NITROPHENYL)25DIOXO2PYRROL1YLSPIRO(78DIHYDRO6HQUINOLINE43INDOLE)3CARBONITRILE
CCN1C2=CC=CC=C2C3(C1=O)C(=C(N(C4=C3C(=O)CCC4)C5=C(C=CC(=C5)(N+)(=O)(O))C)N6C=CC=C6)C#N
InChI=1SC30H25N5O4c1333231054921(23)30(29(33)37)22(1831)28(3215671632)34(241181226(36)27(24)30)251720(35(38)39)141319(25)2h479101317H381112H212H3
MFCD06617455
N#CC1=C(n2cccc2)N(c2cc(ccc2C)(N+)(=O)(O))C2=C(C31C(=O)N(c1c3cccc1)CC)C(=O)CCC2
ZINC000012412004
ZINC000012412005
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