Vitas-M small molecule compound
6-amino-8'-ethoxy-3,4',4',6'-tetramethyl-2'-oxo-1-phenyl-1H,4'H-spiro[pyrano[2,3-c]pyrazole-4,1'-pyrrolo[3,2,1-ij]quinoline]-5-carbonitrile
Catalog ID
STK203041
SMILES CCOc1cc2C(=CC(N3c2c(c1)C1(C(=C(N)Oc2c1c(C)nn2c1ccccc1)C#N)C3=O)(C)C)C
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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 C29H27N5O3 MW 493.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O3/c1-6-36-19-12-20-16(2)14-28(4,5)33-24(20)21(13-19)29(27(33)35)22(15-30)25(31)37-26-23(29)17(3)32-34(26)18-10-8-7-9-11-18/h7-14H,6,31H2,1-5H3InChIKey
WWISEVCNWAEQEW-UHFFFAOYSA-NSynonyms
6amino8ethoxy3446tetramethyl2oxo1phenyl1H4Hspiro(pyrano(23c)pyrazole41pyrrolo(321ij)quinoline)5carbonitrile
CCOC1=CC2=C3C(=C1)C(=CC(N3C(=O)C24C(=C(OC5=C4C(=NN5C6=CC=CC=C6)C)N)C#N)(C)C)C
InChI=1SC29H27N5O3c163619122016(2)1428(45)3324(20)21(1319)29(27(33)35)22(1530)25(31)372623(29)17(3)3234(26)18108791118h714H631H215H3
MFCD05839463
ZINC000001049619
ZINC000001049621
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