Vitas-M small molecule compound
3-(2-fluorophenyl)-2-{4-methoxy-3-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}-2,3-dihydroquinazolin-4(1H)-one
Catalog ID
STK723143
SMILES COc1ccc(cc1Cn1ncc(c1)[N+](=O)[O-])C1Nc2ccccc2C(=O)N1c1ccccc1F
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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 C25H20FN5O4 MW 473.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5O4/c1-35-23-11-10-16(12-17(23)14-29-15-18(13-27-29)31(33)34)24-28-21-8-4-2-6-19(21)25(32)30(24)22-9-5-3-7-20(22)26/h2-13,15,24,28H,14H2,1H3InChIKey
UJYOUSICZXTTHQ-UHFFFAOYSA-NSynonyms
312310-87-53(2fluorophenyl)2(4methoxy3((4nitro1Hpyrazol1yl)methyl)phenyl)23dihydroquinazolin4(1H)one
3(2FLUOROPHENYL)2(4METHOXY3((4NITROPYRAZOL1YL)METHYL)PHENYL)12DIHYDROQUINAZOLIN4ONE
312310875
COC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4F)CN5C=C(C=N5)(N+)(=O)(O)
COc1ccc(cc1Cn1ncc(c1)(N+)(=O)(O))C1Nc2ccccc2C(=O)N1c1ccccc1F
InChI=1SC25H20FN5O4c13523111016(1217(23)14291518(132729)31(33)34)242821842619(21)25(32)30(24)22953720(22)26h213152428H14H21H3
MFCD01875972
ZINC000002271450
ZINC000002271451
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