Vitas-M small molecule compound
6-amino-4-(5-nitrothiophen-2-yl)-3-propyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK526879
SMILES CCCc1n[nH]c2c1C(c1ccc(s1)[N+](=O)[O-])C(=C(O2)N)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 C14H13N5O3S MW 331.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N5O3S/c1-2-3-8-12-11(9-4-5-10(23-9)19(20)21)7(6-15)13(16)22-14(12)18-17-8/h4-5,11H,2-3,16H2,1H3,(H,17,18)InChIKey
OPWHGQKFABUSPF-UHFFFAOYSA-NSynonyms
315246-47-0(4R)6AMINO4(5NITROTHIOPHEN2YL)3PROPYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
(4S)6AMINO4(5NITROTHIOPHEN2YL)3PROPYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
315246470
6amino4(5nitrothiophen2yl)3propyl14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(5NITROTHIOPHEN2YL)3PROPYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=C(S3)(N+)(=O)(O)
CCCc1n(nH)c2c1C(c1ccc(s1)(N+)(=O)(O))C(=C(O2)N)C#N
InChI=1SC14H13N5O3Sc12381211(94510(239)19(20)21)7(615)13(16)2214(12)18178h4511H2316H21H3(H1718)
MFCD01944457
ZINC000009122161
ZINC000009122162
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