Vitas-M small molecule compound
benzyl 6'-amino-5'-cyano-3'-propyl-1H,1'H-spiro[piperidine-4,4'-pyrano[2,3-c]pyrazole]-1-carboxylate
Catalog ID
STL043845
SMILES CCCc1n[nH]c2c1C1(CCN(CC1)C(=O)OCc1ccccc1)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 C22H25N5O3 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O3/c1-2-6-17-18-20(26-25-17)30-19(24)16(13-23)22(18)9-11-27(12-10-22)21(28)29-14-15-7-4-3-5-8-15/h3-5,7-8H,2,6,9-12,14,24H2,1H3,(H,25,26)InChIKey
LCLPBFROYPHOAO-UHFFFAOYSA-NSynonyms
488861-57-0488861570
benzyl6amino5cyano3propyl1H1Hspiro(piperidine44pyrano(23c)pyrazole)1carboxylate
benzyl6amino5cyano3propyl2Hspiro(piperidine44pyrano(23c)pyrazole)1carboxylate
BENZYL6AMINO5CYANO3PROPYLSPIRO(2HPYRANO(23C)PYRAZOLE44PIPERIDINE)1CARBOXYLATE
CCCc1(nH)nc2c1C1(CCN(CC1)C(=O)OCc1ccccc1)C(=C(O2)N)C#N
CCCC1=C2C(=NN1)OC(=C(C23CCN(CC3)C(=O)OCC4=CC=CC=C4)C#N)N
CCCc1n(nH)c2c1C1(CCN(CC1)C(=O)OCc1ccccc1)C(=C(O2)N)C#N
InChI=1SC22H25N5O3c126171820(262517)3019(24)16(1323)22(18)91127(121022)21(28)2914157435815h3578H269121424H21H3(H2526)
MFCD03802494
PHENYLMETHYL6AMINO5CYANO3PROPYLSPIRO(4HPYRANO(23C)PYRAZOLE44PIPERIDINE)10CARBOXYLATE
SPIRO2(4AMINO9PROPYL5OXO78DIAZBICYCLO(430)NONA369TRIENE3CARBONITRILE)4(1BENZYLOXYCARBONYLPIPERDINE)
ZINC000004042756
ZINC4042756
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