Vitas-M small molecule compound
ethyl 6'-amino-3'-butyl-5'-cyano-1H,2'H-spiro[piperidine-4,4'-pyrano[2,3-c]pyrazole]-1-carboxylate
Catalog ID
STL053719
SMILES CCCCc1[nH]nc2c1C1(CCN(CC1)C(=O)OCC)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 C18H25N5O3 MW 359.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N5O3/c1-3-5-6-13-14-16(22-21-13)26-15(20)12(11-19)18(14)7-9-23(10-8-18)17(24)25-4-2/h3-10,20H2,1-2H3,(H,21,22)InChIKey
AGQORNMBDFZCRG-UHFFFAOYSA-NSynonyms
627053-23-0627053230
CCCCc1(nH)nc2c1C1(CCN(CC1)C(=O)OCC)C(=C(O2)N)C#N
CCCCC1=C2C(=NN1)OC(=C(C23CCN(CC3)C(=O)OCC)C#N)N
ethyl6amino3butyl5cyano1H2Hspiro(piperidine44pyrano(23c)pyrazole)1carboxylate
ethyl6amino3butyl5cyano2Hspiro(piperidine44pyrano(23c)pyrazole)1carboxylate
ETHYL6AMINO3BUTYL5CYANOSPIRO(2HPYRANO(23C)PYRAZOLE44PIPERIDINE)1CARBOXYLATE
ETHYL6AMINO3BUTYL5CYANOSPIRO(4HPYRANO(23C)PYRAZOLE44PIPERIDINE)10CARBOXYLATE
InChI=1SC18H25N5O3c1356131416(222113)2615(20)12(1119)18(14)7923(10818)17(24)2542h31020H212H3(H2122)
MFCD03828476
ZINC000003908431
ZINC03908431
ZINC3908431
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