Vitas-M small molecule compound
(5Z)-1-(3-chlorophenyl)-5-({[2-(1H-imidazol-5-yl)ethyl]amino}[(4-methylphenyl)amino]methylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Catalog ID
STL448567
SMILES Cc1ccc(cc1)N/C(=C\1/C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl)/NCCc1[nH]cnc1
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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 C23H21ClN6O3 MW 464.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN6O3/c1-14-5-7-16(8-6-14)28-20(26-10-9-17-12-25-13-27-17)19-21(31)29-23(33)30(22(19)32)18-4-2-3-15(24)11-18/h2-8,11-13,26,28H,9-10H2,1H3,(H,25,27)(H,29,31,33)/b20-19-InChIKey
CUSRDSMBIQPYRK-VXPUYCOJSA-NSynonyms
(5Z)1(3chlorophenyl)5(((2(1Himidazol5yl)ethyl)amino)((4methylphenyl)amino)methylidene)pyrimidine246(1H3H5H)trione
(5Z)1(3chlorophenyl)5((2(1Himidazol5yl)ethylamino)(4methylanilino)methylidene)13diazinane246trione
CC1=CC=C(C=C1)NC(=C2C(=O)NC(=O)N(C2=O)C3=CC(=CC=C3)Cl)NCCC4=CN=CN4
Cc1ccc(cc1)NC(=C1C(=O)NC(=O)N(C1=O)c1cccc(c1)Cl)NCCc1(nH)cnc1
InChI=1SC23H21ClN6O3c1145716(8614)2820(26109171225132717)1921(31)2923(33)30(22(19)32)1842315(24)1118h2811132628H910H21H3(H2527)(H293133)b2019
MFCD07773996
ZINC000101378220
ZINC101378220
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