Vitas-M small molecule compound
(5E)-1-(4-chlorophenyl)-2,6-dioxo-5-{1-[(pyridinium-3-ylmethyl)amino]ethylidene}-1,2,5,6-tetrahydropyrimidin-4-olate
Catalog ID
STK570241
SMILES Clc1ccc(cc1)N1C(=O)N=C(/C(=C(\NCc2ccc[nH+]c2)/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 C18H15ClN4O3 MW 370.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN4O3/c1-11(21-10-12-3-2-8-20-9-12)15-16(24)22-18(26)23(17(15)25)14-6-4-13(19)5-7-14/h2-9,21H,10H2,1H3,(H,22,24,26)/b15-11+InChIKey
JVYZKBJXEHILRX-RVDMUPIBSA-NSynonyms
(5E)1(4chlorophenyl)26dioxo5(1((pyridinium3ylmethyl)amino)ethylidene)1256tetrahydropyrimidin4olate
(5E)1(4CHLOROPHENYL)46DIOXO5(1(PYRIDIN1IUM3YLMETHYLAMINO)ETHYLIDENE)PYRIMIDIN2OLATE
(5E)1(4CHLOROPHENYL)5(1(PYRIDIN3YLMETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
1(4CHLOROPHENYL)5(1((PYRIDIN3YLMETHYL)AMINO)ETH(E)YLIDENE)PYRIMIDINE246TRIONE
CC(=C1C(=O)N=C(N(C1=O)C2=CC=C(C=C2)Cl)(O))NCC3=C(NH+)=CC=C3
Clc1ccc(cc1)N1C(=O)N=C(C(=C(NCc2ccc(nH+)c2)C)C1=O)(O)
InChI=1SC18H15ClN4O3c111(21101232820912)1516(24)2218(26)23(17(15)25)146413(19)5714h2921H10H21H3(H222426)b1511+
MFCD18245347
ZINC000005624604
ZINC05624604
ZINC5624604
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