Vitas-M small molecule compound

1-[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-4(5H)-yl]-2-methoxyethanone

Catalog ID
STK222463
SMILES COCC(=O)N1C(CC(n2c1ncn2)c1ccc(cc1)OC)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 C21H21ClN4O3 MW 412.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O3/c1-28-12-20(27)25-18(14-3-7-16(22)8-4-14)11-19(26-21(25)23-13-24-26)15-5-9-17(29-2)10-6-15/h3-10,13,18-19H,11-12H2,1-2H3
InChIKey
GBWXFNJDBBDPES-UHFFFAOYSA-N
Synonyms

1(5(4CHLOROPHENYL)7(4METHOXYPHENYL)67DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN4(5H)YL)2METHOXYETHANONE
1(5(4CHLOROPHENYL)7(4METHOXYPHENYL)67DIHYDRO5H(124)TRIAZOLO(15A)PYRIMIDIN4YL)2METHOXYETHANONE
COCC(=O)N1C(CC(N2C1=NC=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)Cl
InChI=1SC21H21ClN4O3c1281220(27)2518(143716(22)8414)1119(2621(25)23132426)155917(292)10615h310131819H1112H212H3
MFCD07792247
ZINC000004816789
ZINC000004816792

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Available files

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