Vitas-M small molecule compound
ethyl 7-{4-[(3,4-dichlorobenzyl)oxy]-3-ethoxyphenyl}-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STL456176
SMILES CCOC(=O)C1=C(Nc2n(C1c1ccc(c(c1)OCC)OCc1ccc(c(c1)Cl)Cl)ncn2)c1ccccc1
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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 C29H26Cl2N4O4 MW 565.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26Cl2N4O4/c1-3-37-24-15-20(11-13-23(24)39-16-18-10-12-21(30)22(31)14-18)27-25(28(36)38-4-2)26(19-8-6-5-7-9-19)34-29-32-17-33-35(27)29/h5-15,17,27H,3-4,16H2,1-2H3,(H,32,33,34)InChIKey
PHGQNWSLAWYAQO-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C4=CC=CC=C4)C(=O)OCC)OCC5=CC(=C(C=C5)Cl)Cl
ethyl7(4((34dichlorobenzyl)oxy)3ethoxyphenyl)5phenyl47dihydro(124)triazolo(15a)pyrimidine6carboxylate
ETHYL7(4((34DICHLOROPHENYL)METHOXY)3ETHOXYPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7(4(34DICHLOROBENZYLOXY)3ETHOXYPHENYL)5PHENYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H26Cl2N4O4c1337241520(111323(24)391618101221(30)22(31)1418)2725(28(36)3842)26(198657919)342932173335(27)29h5151727H3416H212H3(H323334)
MFCD04556555
ZINC000003770931
ZINC000003770932
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