Vitas-M small molecule compound
7-{3-ethoxy-4-[(4-methylbenzyl)oxy]phenyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185062
SMILES CCOc1cc(ccc1OCc1ccc(cc1)C)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 C30H31N5O3 MW 509.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N5O3/c1-5-37-26-16-23(14-15-25(26)38-17-22-12-10-19(2)11-13-22)28-27(21(4)33-30-31-18-32-35(28)30)29(36)34-24-9-7-6-8-20(24)3/h6-16,18,28H,5,17H2,1-4H3,(H,34,36)(H,31,32,33)InChIKey
AYBFGKRDQQRHIL-UHFFFAOYSA-NSynonyms
7(3ETHOXY4((4METHYLBENZYL)OXY)PHENYL)5METHYLN(2METHYLPHENYL)47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
7(3ethoxy4((4methylphenyl)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)C
InChI=1SC30H31N5O3c1537261623(141525(26)381722121019(2)111322)2827(21(4)333031183235(28)30)29(36)3424976820(24)3h6161828H517H214H3(H3436)(H313233)
MFCD06757377
ZINC000009907064
ZINC000009907067
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