Vitas-M small molecule compound
2-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethyl 2-(4-butoxyphenyl)quinoline-4-carboxylate
Catalog ID
STK435227
SMILES CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)OCCNc1ccc2c(c1[N+](=O)[O-])non2
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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 C28H25N5O6 MW 527.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N5O6/c1-2-3-15-37-19-10-8-18(9-11-19)25-17-21(20-6-4-5-7-22(20)30-25)28(34)38-16-14-29-24-13-12-23-26(32-39-31-23)27(24)33(35)36/h4-13,17,29H,2-3,14-16H2,1H3InChIKey
DHEXTTQZJDMDQD-UHFFFAOYSA-NSynonyms
2((4nitro213benzoxadiazol5yl)amino)ethyl2(4butoxyphenyl)quinoline4carboxylate
2((4NITROBENZO(C)125OXADIAZOL5YL)AMINO)ETHYL2(4BUTOXYPHENYL)QUINOLINE4CARBOXYLATE
CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)OCCNC4=C(C5=NON=C5C=C4)(N+)(=O)(O)
CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)OCCNc1ccc2c(c1(N+)(=O)(O))non2
InChI=1SC28H25N5O6c12315371910818(91119)251721(20645722(20)3025)28(34)381614292413122326(32393123)27(24)33(35)36h4131729H231416H21H3
MFCD03943101
ZINC000097945456
ZINC97945456
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