Vitas-M small molecule compound
7-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK189894
SMILES CCOc1cc(ccc1OCc1ccc(cc1)F)C1C(=C(C)Nc2n1ncn2)C(=O)Nc1ccccc1C
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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 C29H28FN5O3 MW 513.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN5O3/c1-4-37-25-15-21(11-14-24(25)38-16-20-9-12-22(30)13-10-20)27-26(19(3)33-29-31-17-32-35(27)29)28(36)34-23-8-6-5-7-18(23)2/h5-15,17,27H,4,16H2,1-3H3,(H,34,36)(H,31,32,33)InChIKey
MTOXAQTUBHVKMZ-UHFFFAOYSA-NSynonyms
7(3ETHOXY4((4FLUOROBENZYL)OXY)PHENYL)5METHYLN(2METHYLPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(3ethoxy4((4fluorophenyl)methoxy)phenyl)5methylN(2methylphenyl)17dihydro(124)triazolo(15a)pyrimidine6carboxamide
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)NC4=CC=CC=C4C)OCC5=CC=C(C=C5)F
InChI=1SC29H28FN5O3c1437251521(111424(25)38162091222(30)131020)2726(19(3)332931173235(27)29)28(36)3423865718(23)2h5151727H416H213H3(H3436)(H313233)
MFCD06757387
ZINC000009908212
ZINC000009908213
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