Vitas-M small molecule compound
methyl 6'-amino-1-benzyl-2-oxo-3'-phenyl-1,2-dihydro-2'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Catalog ID
STK568229
SMILES COC(=O)C1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)Cc1ccccc1)c([nH]n2)c1ccccc1
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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 C28H22N4O4 MW 478.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O4/c1-35-26(33)22-24(29)36-25-21(23(30-31-25)18-12-6-3-7-13-18)28(22)19-14-8-9-15-20(19)32(27(28)34)16-17-10-4-2-5-11-17/h2-15H,16,29H2,1H3,(H,30,31)InChIKey
QRWQPRQTNPBFKS-UHFFFAOYSA-NSynonyms
848922-29-2848922292
COC(=O)C1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)Cc1ccccc1)c((nH)n2)c1ccccc1
COC(=O)C1=C(N)Oc2c(C31C(=O)N(c1c3cccc1)Cc1ccccc1)c(n(nH)2)c1ccccc1
COC(=O)C1=C(OC2=NNC(=C2C13C4=CC=CC=C4N(C3=O)CC5=CC=CC=C5)C6=CC=CC=C6)N
InChI=1SC28H22N4O4c13526(33)2224(29)362521(23(303125)18126371318)28(22)1914891520(19)32(27(28)34)1617104251117h215H1629H21H3(H3031)
methyl6amino1benzyl2oxo3phenyl12dihydro2Hspiro(indole34pyrano(23c)pyrazole)5carboxylate
methyl6amino1benzyl2oxo3phenyl1Hspiro(indoline34pyrano(23c)pyrazole)5carboxylate
METHYL6AMINO1BENZYL2OXO3PHENYLSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)5CARBOXYLATE
MFCD05725980
ZINC000009243915
ZINC000009243916
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.