Vitas-M small molecule compound
2-amino-6'-methyl-2',5-dioxo-5,5',6,6',7,8-hexahydrodispiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline-4',1''-cyclohexane]-3-carbonitrile
Catalog ID
STL361725
SMILES N#CC1=C(N)OC2=C(C31c1cccc4c1N(C3=O)C1(CCCCC1)CC4C)C(=O)CCC2
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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 C26H27N3O3 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3/c1-15-13-25(11-3-2-4-12-25)29-22-16(15)7-5-8-17(22)26(24(29)31)18(14-27)23(28)32-20-10-6-9-19(30)21(20)26/h5,7-8,15H,2-4,6,9-13,28H2,1H3InChIKey
IWMLXEGTYCDVEI-UHFFFAOYSA-NSynonyms
2amino6methyl25dioxo556678hexahydrodispiro(chromene41pyrrolo(321ij)quinoline41cyclohexane)3carbonitrile
CC1CC2(CCCCC2)N3C4=C1C=CC=C4C5(C3=O)C(=C(OC6=C5C(=O)CCC6)N)C#N
InChI=1SC26H27N3O3c1151325(113241225)292216(15)75817(22)26(24(29)31)18(1427)23(28)3220106919(30)21(20)26h57815H24691328H21H3
MFCD28033895
ZINC000095115726
ZINC000095115729
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