Vitas-M small molecule compound

ethyl (2E)-3-amino-3-({(E)-amino[(4,6,7-trimethylquinazolin-2-yl)amino]methylidene}amino)-2-(phenylcarbonyl)prop-2-enoate - ethane (1:1)

Catalog ID
STK210691
SMILES CCOC(=O)/C(=C(/N=C(/Nc1nc(C)c2c(n1)cc(c(c2)C)C)\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 C26H32N6O3 MW 476.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O3.C2H6/c1-5-33-22(32)19(20(31)16-9-7-6-8-10-16)21(25)29-23(26)30-24-27-15(4)17-11-13(2)14(3)12-18(17)28-24;1-2/h6-12H,5,25H2,1-4H3,(H3,26,27,28,29,30);1-2H3/b21-19+;
InChIKey
SXFVDMPURJJFCY-UXJRWBAGSA-N
Synonyms

CCCCOC(=O)C(=C(N)NC(=NC1=NC2=CC(=C(C=C2C(=N1)C)C)C)N)C(=O)C3=CC=CC=C3
CCOC(=O)C(=C(N=C(Nc1nc(C)c2c(n1)cc(c(c2)C)C)N)N)C(=O)c1ccccc1CC
ethaneethyl(E)3amino2benzoyl3(((E)N(467trimethylquinazolin2yl)carbamimidoyl)amino)prop2enoate
ethyl(2E)3amino3(((E)amino((467trimethylquinazolin2yl)amino)methylidene)amino)2(phenylcarbonyl)prop2enoateethane(11)
ETHYL(2E4E)35DIAMINO2(PHENYLCARBONYL)5((467TRIMETHYLQUINAZOLIN2YL)AMINO)4AZAPENTA24DIENOATEETHANE
InChI=1SC24H26N6O3C2H6c153322(32)19(20(31)1697681016)21(25)2923(26)30242715(4)171113(2)14(3)1218(17)282412h612H525H214H3(H32627282930)12H3b2119+

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Available files

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