Vitas-M small molecule compound
ethyl 6-amino-3-butyl-5-cyano-1'H,7H-spiro[1,2-oxazolo[3,4-b]pyridine-4,4'-piperidine]-1'-carboxylate
Catalog ID
STK783450
SMILES CCCCc1onc2c1C1(CCN(CC1)C(=O)OCC)C(=C(N2)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(22-26-13)21-15(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
OZKFBLIFBVZJLJ-UHFFFAOYSA-NSynonyms
CCCCC1=C2C(=NC(=C(C23CCN(CC3)C(=O)OCC)C#N)N)NO1
ethyl6amino3butyl5cyano1H7Hspiro(12oxazolo(34b)pyridine44piperidine)1carboxylate
ETHYL6AMINO3BUTYL5CYANOSPIRO(1H(12)OXAZOLO(34B)PYRIDINE44PIPERIDINE)1CARBOXYLATE
ETHYL6AMINO3BUTYL5CYANOSPIRO(47DIHYDROISOXAZOLO(34B)PYRIDINE44PIPERIDINE)10CARBOXYLATE
InChI=1SC18H25N5O3c1356131416(222613)2115(20)12(1119)18(14)7923(10818)17(24)2542h31020H212H3(H2122)
MFCD06618250
ZINC000004751272
ZINC04751272
ZINC4751272
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