Vitas-M small molecule compound
6-amino-4-[3-ethoxy-5-iodo-4-(prop-2-yn-1-yloxy)phenyl]-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL379792
SMILES C#CCOc1c(I)cc(cc1OCC)C1C(=C(N)Oc2c1c(C)n[nH]2)C#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 C19H17IN4O3 MW 476.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17IN4O3/c1-4-6-26-17-13(20)7-11(8-14(17)25-5-2)16-12(9-21)18(22)27-19-15(16)10(3)23-24-19/h1,7-8,16H,5-6,22H2,2-3H3,(H,23,24)InChIKey
CKWIWGCSBNYVNJ-UHFFFAOYSA-NSynonyms
(4R)6AMINO4(3ETHOXY5IODO4(PROP2YN1YLOXY)PHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(3ETHOXY5IODO4(2PROPYNYLOXY)PHENYL)3METHYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino4(3ethoxy5iodo4(prop2yn1yloxy)phenyl)3methyl14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3ETHOXY5IODO4PROP2YNOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
C#CCOc1c(I)cc(cc1OCC)C1C(=C(N)Oc2c1c(C)n(nH)2)C#N
CCOC1=C(C(=CC(=C1)C2C(=C(OC3=NNC(=C23)C)N)C#N)I)OCC#C
InChI=1SC19H17IN4O3c146261713(20)711(814(17)2552)1612(921)18(22)271915(16)10(3)232419h17816H5622H223H3(H2324)
MFCD04091235
ZINC000008426006
ZINC000008426008
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