Vitas-M small molecule compound
N-benzyl-7-[4-(benzyloxy)-3-ethoxyphenyl]-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Catalog ID
STK185016
SMILES CCOc1cc(ccc1OCc1ccccc1)C1C(=C(C)Nc2n1ncn2)C(=O)NCc1ccccc1
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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/c1-3-36-25-16-23(14-15-24(25)37-18-22-12-8-5-9-13-22)27-26(20(2)33-29-31-19-32-34(27)29)28(35)30-17-21-10-6-4-7-11-21/h4-16,19,27H,3,17-18H2,1-2H3,(H,30,35)(H,31,32,33)InChIKey
SZSQIEGNMYWHBH-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2NC=N3)C)C(=O)NCC4=CC=CC=C4)OCC5=CC=CC=C5
InChI=1SC29H29N5O3c1336251623(141524(25)371822128591322)2726(20(2)332931193234(27)29)28(35)301721106471121h4161927H31718H212H3(H3035)(H313233)
MFCD06136199
Nbenzyl7(3ethoxy4phenylmethoxyphenyl)5methyl17dihydro(124)triazolo(15a)pyrimidine6carboxamide
NBENZYL7(4(BENZYLOXY)3ETHOXYPHENYL)5METHYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXAMIDE
ZINC000009907027
ZINC000009907029
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