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(5E)-5-{1-[(1-benzylpiperidinium-4-yl)amino]ethylidene}-4,6-dioxo-1-(prop-2-en-1-yl)-1,4,5,6-tetrahydropyrimidin-2-olate

Catalog ID
STL053132
SMILES C=CCN1C(=NC(=O)/C(=C(\NC2CC[NH+](CC2)Cc2ccccc2)/C)/C1=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 C21H26N4O3 MW 382.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O3/c1-3-11-25-20(27)18(19(26)23-21(25)28)15(2)22-17-9-12-24(13-10-17)14-16-7-5-4-6-8-16/h3-8,17,22H,1,9-14H2,2H3,(H,23,26,28)/b18-15+
InChIKey
LRKBSBCFXARQKE-OBGWFSINSA-N
Synonyms

(5E)1ALLYL5(1((1BENZYL4PIPERIDYL)AMINO)ETHYLIDENE)BARBITURICACID
(5E)5(1((1(PHENYLMETHYL)4PIPERIDINYL)AMINO)ETHYLIDENE)1PROP2ENYL13DIAZINANE246TRIONE
(5E)5(1((1(PHENYLMETHYL)PIPERIDIN4YL)AMINO)ETHYLIDENE)1PROP2ENYL13DIAZINANE246TRIONE
(5E)5(1((1BENZYLPIPERIDIN1IUM4YL)AMINO)ETHYLIDENE)46DIOXO1PROP2ENYLPYRIMIDIN2OLATE
(5E)5(1((1BENZYLPIPERIDIN4YL)AMINO)ETHYLIDENE)1PROP2ENYL13DIAZINANE246TRIONE
(5E)5(1((1benzylpiperidinium4yl)amino)ethylidene)46dioxo1(prop2en1yl)1456tetrahydropyrimidin2olate
1ALLYL5(1(1BENZYLPIPERIDIN4YLAMINO)ETH(E)YLIDENE)PYRIMIDINE246TRIONE
C=CCN1C(=NC(=O)C(=C(NC2CC(NH+)(CC2)Cc2ccccc2)C)C1=O)(O)
CC(=C1C(=O)N=C(N(C1=O)CC=C)(O))NC2CC(NH+)(CC2)CC3=CC=CC=C3
InChI=1SC21H26N4O3c13112520(27)18(19(26)2321(25)28)15(2)221791224(131017)14167546816h381722H1914H22H3(H232628)b1815+
MFCD18249518
ZINC000001273719
ZINC1273719

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Available files

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