Vitas-M small molecule compound
[(3S)-2-ethyl-3-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl](4-nitrophenyl)methanone
Catalog ID
STK089367
SMILES CCC1[C@@H](C)C(Nc2ccccc2)c2c(N1C(=O)c1ccc(cc1)[N+](=O)[O-])cccc2
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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 C25H25N3O3 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3/c1-3-22-17(2)24(26-19-9-5-4-6-10-19)21-11-7-8-12-23(21)27(22)25(29)18-13-15-20(16-14-18)28(30)31/h4-17,22,24,26H,3H2,1-2H3/t17-,22?,24?/m1/s1InChIKey
AHJVMUCXWPUDTK-CVOKNGKCSA-NSynonyms
((3S)2ETHYL3METHYL4(PHENYLAMINO)34DIHYDROQUINOLIN1(2H)YL)(4NITROPHENYL)METHANONE
((3S)4anilino2ethyl3methyl34dihydro2Hquinolin1yl)(4nitrophenyl)methanone
(2ethyl3methyl4(phenylamino)34dihydroquinolin1(2H)yl)(4nitrophenyl)methanone
CCC1(C@@H)(C)C(Nc2ccccc2)c2c(N1C(=O)c1ccc(cc1)(N+)(=O)(O))cccc2
CCC1C(C(C2=CC=CC=C2N1C(=O)C3=CC=C(C=C3)(N+)(=O)(O))NC4=CC=CC=C4)C
CCC1C(C)C(Nc2ccccc2)c2c(N1C(=O)c1ccc(cc1)(N+)(=O)(O))cccc2
InChI=1SC25H25N3O3c132217(2)24(261995461019)2111781223(21)27(22)25(29)18131520(161418)28(30)31h417222426H3H212H3t1722?24?m1s1
MFCD10465573
STK089367
ZINC000004663425
ZINC000004663428
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