Vitas-M small molecule compound
3-(3-hydroxyphenyl)-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]quinazolin-4(3H)-one
Catalog ID
STK835626
SMILES Oc1cccc(c1)n1c(/C=C/c2ccc(o2)[N+](=O)[O-])nc2c(c1=O)cccc2
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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 C20H13N3O5 MW 375.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O5/c24-14-5-3-4-13(12-14)22-18(10-8-15-9-11-19(28-15)23(26)27)21-17-7-2-1-6-16(17)20(22)25/h1-12,24H/b10-8+InChIKey
NEPVSKGTUMGMPB-CSKARUKUSA-NSynonyms
(E)3(3hydroxyphenyl)2(2(5nitrofuran2yl)vinyl)quinazolin4(3H)one
3(3hydroxyphenyl)2((E)2(5nitrofuran2yl)ethenyl)quinazolin4(3H)one
3(3HYDROXYPHENYL)2((E)2(5NITROFURAN2YL)ETHENYL)QUINAZOLIN4ONE
C1=CC=C2C(=C1)C(=O)N(C(=N2)C=CC3=CC=C(O3)(N+)(=O)(O))C4=CC(=CC=C4)O
InChI=1SC20H13N3O5c241453413(1214)2218(1081591119(2815)23(26)27)2117721616(17)20(22)25h11224Hb108+
MFCD02986798
Oc1cccc(c1)n1c(C=Cc2ccc(o2)(N+)(=O)(O))nc2c(c1=O)cccc2
ZINC000004371354
ZINC04371354
ZINC4371354
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