Vitas-M small molecule compound

6-(1,3-benzodioxol-5-ylmethyl)-5-(4-chlorophenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione

Catalog ID
STK692580
SMILES Clc1ccc(cc1)c1n(Cc2ccc3c(c2)OCO3)cc2c1c(=O)n(c(=O)n2C)C

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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 C22H18ClN3O4 MW 423.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O4/c1-24-16-11-26(10-13-3-8-17-18(9-13)30-12-29-17)20(14-4-6-15(23)7-5-14)19(16)21(27)25(2)22(24)28/h3-9,11H,10,12H2,1-2H3
InChIKey
KHJGSGYTRDWNRQ-UHFFFAOYSA-N
Synonyms

6(13benzodioxol5ylmethyl)5(4chlorophenyl)13dimethyl1Hpyrrolo(34d)pyrimidine24(3H6H)dione
6(13benzodioxol5ylmethyl)5(4chlorophenyl)13dimethylpyrrolo(34d)pyrimidine24dione
CN1C2=CN(C(=C2C(=O)N(C1=O)C)C3=CC=C(C=C3)Cl)CC4=CC5=C(C=C4)OCO5
InChI=1SC22H18ClN3O4c124161126(1013381718(913)30122917)20(144615(23)7514)19(16)21(27)25(2)22(24)28h3911H1012H212H3
MFCD10038606
ZINC000015084172
ZINC15084172

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Available files

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