Vitas-M small molecule compound
ethyl 6'-amino-1-(2-ethoxy-2-oxoethyl)-3'-methyl-2-oxo-1,2-dihydro-1'H-spiro[indole-3,4'-pyrano[2,3-c]pyrazole]-5'-carboxylate
Catalog ID
STK729780
SMILES CCOC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)Oc1c2c(C)n[nH]1)C(=O)OCC
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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 C21H22N4O6 MW 426.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O6/c1-4-29-14(26)10-25-13-9-7-6-8-12(13)21(20(25)28)15-11(3)23-24-18(15)31-17(22)16(21)19(27)30-5-2/h6-9H,4-5,10,22H2,1-3H3,(H,23,24)InChIKey
SAJKIRDNQSYBRS-UHFFFAOYSA-NSynonyms
(S)ethyl6amino1(2ethoxy2oxoethyl)3methyl2oxo1Hspiro(indoline34pyrano(23c)pyrazole)5carboxylate
CCOC(=O)CN1C2=CC=CC=C2C3(C1=O)C4=C(NN=C4OC(=C3C(=O)OCC)N)C
CCOC(=O)CN1c2ccccc2(C@@)2(C1=O)C(=C(N)Oc1c2c(C)n(nH)1)C(=O)OCC
CCOC(=O)CN1c2ccccc2C2(C1=O)C(=C(N)Oc1c2c(C)n(nH)1)C(=O)OCC
ethyl6amino1(2ethoxy2oxoethyl)3methyl2oxo12dihydro1Hspiro(indole34pyrano(23c)pyrazole)5carboxylate
ETHYL6AMINO1(2ETHOXY2OXOETHYL)3METHYL2OXOSPIRO(2HPYRANO(23C)PYRAZOLE43INDOLE)5CARBOXYLATE
InChI=1SC21H22N4O6c142914(26)102513976812(13)21(20(25)28)1511(3)232418(15)3117(22)16(21)19(27)3052h69H451022H213H3(H2324)
MFCD13371789
ZINC000009375121
ZINC000009695240
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