Vitas-M small molecule compound
(2E)-1-[(2R,4R)-2-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl]-3-(4-nitrophenyl)prop-2-en-1-one
Catalog ID
STK829743
SMILES C[C@@H]1C[C@@H](Nc2ccccc2)c2c(N1C(=O)/C=C/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 C25H23N3O3 MW 413.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O3/c1-18-17-23(26-20-7-3-2-4-8-20)22-9-5-6-10-24(22)27(18)25(29)16-13-19-11-14-21(15-12-19)28(30)31/h2-16,18,23,26H,17H2,1H3/b16-13+/t18-,23-/m1/s1InChIKey
ALYZJQCCXDFYMP-QQZGCWSASA-NSynonyms
(2E)1((2R4R)2METHYL4(PHENYLAMINO)34DIHYDROQUINOLIN1(2H)YL)3(4NITROPHENYL)PROP2EN1ONE
(E)1((2R4R)4ANILINO2METHYL34DIHYDRO2HQUINOLIN1YL)3(4NITROPHENYL)PROP2EN1ONE
(E)1(2methyl4(phenylamino)34dihydroquinolin1(2H)yl)3(4nitrophenyl)prop2en1one
C(C@@H)1C(C@@H)(Nc2ccccc2)c2c(N1C(=O)C=Cc1ccc(cc1)(N+)(=O)(O))cccc2
CC1CC(C2=CC=CC=C2N1C(=O)C=CC3=CC=C(C=C3)(N+)(=O)(O))NC4=CC=CC=C4
CC1CC(Nc2ccccc2)c2c(N1C(=O)C=Cc1ccc(cc1)(N+)(=O)(O))cccc2
InChI=1SC25H23N3O3c1181723(26207324820)229561024(22)27(18)25(29)161319111421(151219)28(30)31h216182326H17H21H3b1613+t1823m1s1
ZINC04785667
ZINC4785667
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