Vitas-M small molecule compound
7-amino-5-(7-methoxy-1,3-benzodioxol-5-yl)-4-oxo-3,5-dihydro-4H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Catalog ID
STK693905
SMILES N#CC1=C(N)Oc2c(C1c1cc(OC)c3c(c1)OCO3)c(=O)[nH]cn2
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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 C16H12N4O5 MW 340.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O5/c1-22-9-2-7(3-10-13(9)24-6-23-10)11-8(4-17)14(18)25-16-12(11)15(21)19-5-20-16/h2-3,5,11H,6,18H2,1H3,(H,19,20,21)InChIKey
CKXICSOZFMXATJ-UHFFFAOYSA-NSynonyms
7amino5(7methoxy13benzodioxol5yl)4oxo35dihydro4Hpyrano(23d)pyrimidine6carbonitrile
7amino5(7methoxy13benzodioxol5yl)4oxo35dihydropyrano(23d)pyrimidine6carbonitrile
COC1=CC(=CC2=C1OCO2)C3C(=C(OC4=C3C(=O)NC=N4)N)C#N
InChI=1SC16H12N4O5c122927(31013(9)2462310)118(417)14(18)251612(11)15(21)1952016h23511H618H21H3(H192021)
MFCD12034131
N#CC1=C(N)Oc2c(C1c1cc(OC)c3c(c1)OCO3)c(=O)(nH)cn2
ZINC000015109271
ZINC000015109274
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