Vitas-M small molecule compound
7-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK184948
SMILES CCOc1cc(ccc1OCc1ccc(cc1)C)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1ccccc1
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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 C29H29N5O3 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N5O3/c1-4-36-25-16-22(14-15-24(25)37-17-21-12-10-19(2)11-13-21)27-26(20(3)32-29-30-18-31-34(27)29)28(35)33-23-8-6-5-7-9-23/h5-16,18,27H,4,17H2,1-3H3,(H,33,35)(H,30,31,32)InChIKey
IGIDRSPFZJHIGA-UHFFFAOYSA-NSynonyms
7(3ETHOXY4((4METHYLBENZYL)OXY)PHENYL)5METHYLNPHENYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(3ethoxy4((4methylphenyl)methoxy)phenyl)5methylNphenyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)NC4=CC=CC=C4)OCC5=CC=C(C=C5)C
InChI=1SC29H29N5O3c1436251622(141524(25)371721121019(2)111321)2726(20(3)322930183134(27)29)28(35)33238657923h5161827H417H213H3(H3335)(H303132)
MFCD04575984
ZINC000009906843
ZINC000009906846
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