Vitas-M small molecule compound
4,7-diamino-2-(prop-2-yn-1-ylsulfanyl)-5-(pyridin-3-yl)-5H-pyrano[2,3-d]pyrimidine-6-carbonitrile
Catalog ID
STK780213
SMILES C#CCSc1nc(N)c2c(n1)OC(=C(C2c1cccnc1)C#N)N
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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 C16H12N6OS MW 336.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N6OS/c1-2-6-24-16-21-13(18)12-11(9-4-3-5-20-8-9)10(7-17)14(19)23-15(12)22-16/h1,3-5,8,11H,6,19H2,(H2,18,21,22)InChIKey
ISCIEXGQHZZFNE-UHFFFAOYSA-NSynonyms
47diamino2(prop2yn1ylsulfanyl)5(pyridin3yl)5Hpyrano(23d)pyrimidine6carbonitrile
47DIAMINO2(PROP2YNYLTHIO)5PYRIDIN3YL5HPYRANO(23D)PYRIMIDINE6CARBONITRILE
47DIAMINO2PROP2YNYLSULFANYL5PYRIDIN3YL5HPYRANO(23D)PYRIMIDINE6CARBONITRILE
C#CCSC1=NC(=C2C(C(=C(OC2=N1)N)C#N)C3=CN=CC=C3)N
InChI=1SC16H12N6OSc12624162113(18)1211(94352089)10(717)14(19)2315(12)2216h135811H619H2(H2182122)
MFCD05859992
ZINC000004594174
ZINC000004594175
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