Vitas-M small molecule compound
ethyl (2E)-3-amino-3-({(E)-amino[(6-ethoxy-4-methylquinazolin-2-yl)amino]methylidene}amino)-2-(phenylcarbonyl)prop-2-enoate - ethane (1:1)
Catalog ID
STK210689
SMILES CCOC(=O)/C(=C(/N=C(/Nc1nc(C)c2c(n1)ccc(c2)OCC)\N)\N)/C(=O)c1ccccc1.CC
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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 C26H32N6O4 MW 492.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O4.C2H6/c1-4-33-16-11-12-18-17(13-16)14(3)27-24(28-18)30-23(26)29-21(25)19(22(32)34-5-2)20(31)15-9-7-6-8-10-15;1-2/h6-13H,4-5,25H2,1-3H3,(H3,26,27,28,29,30);1-2H3/b21-19+;InChIKey
NUTZVKRCJKBGQM-UXJRWBAGSA-NSynonyms
CCCCOC1=CC2=C(C=C1)N=C(N=C2C)N=C(N)NC(=C(C(=O)C3=CC=CC=C3)C(=O)OCC)N
CCOC(=O)C(=C(N=C(Nc1nc(C)c2c(n1)ccc(c2)OCC)N)N)C(=O)c1ccccc1CC
ethaneethyl(E)3amino2benzoyl3(((E)N(6ethoxy4methylquinazolin2yl)carbamimidoyl)amino)prop2enoate
ethyl(2E)3amino3(((E)amino((6ethoxy4methylquinazolin2yl)amino)methylidene)amino)2(phenylcarbonyl)prop2enoateethane(11)
ETHYL(2E4E)35DIAMINO5((6ETHOXY4METHYLQUINAZOLIN2YL)AMINO)2(PHENYLCARBONYL)4AZAPENTA24DIENOATEETHANE
InChI=1SC24H26N6O4C2H6c14331611121817(1316)14(3)2724(2818)3023(26)2921(25)19(22(32)3452)20(31)159768101512h613H4525H213H3(H32627282930)12H3b2119+
MFCD07422137
ZINC000100130422
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