Vitas-M small molecule compound
ethyl 6-[(4-chlorophenyl)carbonyl]-7-(2,5-dimethoxyphenyl)-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate
Catalog ID
STK693217
SMILES CCOC(=O)C1=C(C(=O)c2ccc(cc2)Cl)C(n2c(N1)nnn2)c1cc(OC)ccc1OC
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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 C22H20ClN5O5 MW 469.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O5/c1-4-33-21(30)18-17(20(29)12-5-7-13(23)8-6-12)19(28-22(24-18)25-26-27-28)15-11-14(31-2)9-10-16(15)32-3/h5-11,19H,4H2,1-3H3,(H,24,25,27)InChIKey
ILZMELXQMPHIFF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C(N2C(=N1)N=NN2)C3=C(C=CC(=C3)OC)OC)C(=O)C4=CC=C(C=C4)Cl
ETHYL6((4CHLOROPHENYL)CARBONYL)7(25DIMETHOXYPHENYL)47DIHYDROTETRAZOLO(15A)PYRIMIDINE5CARBOXYLATE
ethyl6(4chlorobenzoyl)7(25dimethoxyphenyl)17dihydrotetrazolo(15a)pyrimidine5carboxylate
InChI=1SC22H20ClN5O5c143321(30)1817(20(29)125713(23)8612)19(2822(2418)25262728)151114(312)91016(15)323h51119H4H213H3(H242527)
MFCD10039309
ZINC000015105903
ZINC000015105906
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