Vitas-M small molecule compound
(5E)-1-(3-chlorophenyl)-5-(1-{[2-(1H-imidazol-5-yl)ethyl]amino}ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL440595
SMILES Clc1cccc(c1)N1C(=O)NC(=O)/C(=C(\NCCc2[nH]cnc2)/C)/C1=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 C17H16ClN5O3 MW 373.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN5O3/c1-10(20-6-5-12-8-19-9-21-12)14-15(24)22-17(26)23(16(14)25)13-4-2-3-11(18)7-13/h2-4,7-9,20H,5-6H2,1H3,(H,19,21)(H,22,24,26)/b14-10+InChIKey
GKLQHKCQXMCOCQ-GXDHUFHOSA-NSynonyms
(5E)1(3chlorophenyl)5(1((2(1Himidazol5yl)ethyl)amino)ethylidene)pyrimidine246(1H3H5H)trione
(5E)1(3CHLOROPHENYL)5(1(2(1HIMIDAZOL5YL)ETHYLAMINO)ETHYLIDENE)13DIAZINANE246TRIONE
CC(=C1C(=O)NC(=O)N(C1=O)C2=CC(=CC=C2)Cl)NCCC3=CN=CN3
Clc1cccc(c1)N1C(=O)NC(=O)C(=C(NCCc2(nH)cnc2)C)C1=O
InChI=1SC17H16ClN5O3c110(20651281992112)1415(24)2217(26)23(16(14)25)1342311(18)713h247920H56H21H3(H1921)(H222426)b1410+
MFCD07756081
ZINC000006904191
ZINC6904191
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