Vitas-M small molecule compound
2-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-3-(2,4-dimethylphenyl)-6-iodoquinazolin-4(3H)-one
Catalog ID
STK555820
SMILES Cc1ccc(c(c1)C)n1c(/C=C/c2ccc3c(c2)OCO3)nc2c(c1=O)cc(cc2)I
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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 C25H19IN2O3 MW 522.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19IN2O3/c1-15-3-8-21(16(2)11-15)28-24(27-20-7-6-18(26)13-19(20)25(28)29)10-5-17-4-9-22-23(12-17)31-14-30-22/h3-13H,14H2,1-2H3/b10-5+InChIKey
PDSMEHXSKLCHEH-BJMVGYQFSA-NSynonyms
843624-62-4(E)2(2(benzo(d)(13)dioxol5yl)vinyl)3(24dimethylphenyl)6iodoquinazolin4(3H)one
2((E)2(13benzodioxol5yl)ethenyl)3(24dimethylphenyl)6iodoquinazolin4(3H)one
2((E)2(13BENZODIOXOL5YL)ETHENYL)3(24DIMETHYLPHENYL)6IODOQUINAZOLIN4ONE
843624624
CC1=CC(=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC5=C(C=C4)OCO5)C
Cc1ccc(c(c1)C)n1c(C=Cc2ccc3c(c2)OCO3)nc2c(c1=O)cc(cc2)I
InChI=1SC25H19IN2O3c1153821(16(2)1115)2824(27207618(26)1319(20)25(28)29)10517492223(1217)31143022h313H14H212H3b105+
MFCD04013856
ZINC000100026153
ZINC100026153
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