Vitas-M small molecule compound
methyl 7-(4-chlorophenyl)-6-[(3,4-dimethoxyphenyl)carbonyl]-4,7-dihydrotetrazolo[1,5-a]pyrimidine-5-carboxylate
Catalog ID
STK727194
SMILES COC(=O)C1=C(C(=O)c2ccc(c(c2)OC)OC)C(n2c(N1)nnn2)c1ccc(cc1)Cl
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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 C21H18ClN5O5 MW 455.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5O5/c1-30-14-9-6-12(10-15(14)31-2)19(28)16-17(20(29)32-3)23-21-24-25-26-27(21)18(16)11-4-7-13(22)8-5-11/h4-10,18H,1-3H3,(H,23,24,26)InChIKey
RKHRFVFXUJJOQF-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)C(=O)C2=C(N=C3N=NNN3C2C4=CC=C(C=C4)Cl)C(=O)OC)OC
InChI=1SC21H18ClN5O5c130149612(1015(14)312)19(28)1617(20(29)323)232124252627(21)18(16)114713(22)8511h41018H13H3(H232426)
methyl7(4chlorophenyl)6((34dimethoxyphenyl)carbonyl)47dihydrotetrazolo(15a)pyrimidine5carboxylate
METHYL7(4CHLOROPHENYL)6(34DIMETHOXYBENZOYL)17DIHYDROTETRAZOLO(15A)PYRIMIDINE5CARBOXYLATE
MFCD06618544
ZINC000010232341
ZINC000010232342
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