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名称: compound ( 4 )

IUPAC: 3-[4-(methoxymethoxy)-2-phenylmethoxy-5-propan-2-ylphenyl]-4-(6-morpholin-4-yl-3-pyridinyl)-1H-1,2,4-triazol-5-one

SMILES: COCOc1cc(OCc2ccccc2)c(-c2nnc(O)n2-c2ccc(N3CCOCC3)nc2)cc1C(C)C

Canonical SMILES: CC(C)C1=C(C=C(C(=C1)C2=NNC(=O)N2C3=CN=C(C=C3)N4CCOCC4)OCC5=CC=CC=C5)OCOC

分子式: C29H33N5O5

分子量: 531.60

InChIKey: VQJNPWVLFDDYFM-UHFFFAOYSA-N

InChI: InChI=1S/C29H33N5O5/c1-20(2)23-15-24(26(16-25(23)39-19-36-3)38-18-21-7-5-4-6-8-21)28-31-32-29(35)34(28)22-9-10-27(30-17-22)33-11-13-37-14-12-33/h4-10,15-17,20H,11-14,18-19H2,1-3H3,(H,32,35)

PubChem CID: 67341367 →

同义词

SCHEMBL2268209VQJNPWVLFDDYFM-UHFFFAOYSA-N5-(2-(benzyloxy)-5-isopropyl-4-(methoxymethoxy)phenyl)-4-(6-morpholinopyridin-3-yl)-4H-1,2,4-triazol-3-ol

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