Vitas-M small molecule compound
2-amino-1-(2-fluorophenyl)-7,7-dimethyl-4-(3-nitrophenyl)-5-oxo-N-(1,3-thiazol-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STK686741
SMILES O=C(C1=C(N)N(C2=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)CC(C2)(C)C)c1ccccc1F)Nc1nccs1
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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 C27H24FN5O4S MW 533.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24FN5O4S/c1-27(2)13-19-22(20(34)14-27)21(15-6-5-7-16(12-15)33(36)37)23(25(35)31-26-30-10-11-38-26)24(29)32(19)18-9-4-3-8-17(18)28/h3-12,21H,13-14,29H2,1-2H3,(H,30,31,35)InChIKey
FSWZJXXIUBHOLN-UHFFFAOYSA-NSynonyms
2amino1(2fluorophenyl)77dimethyl4(3nitrophenyl)5oxoN(13thiazol2yl)145678hexahydroquinoline3carboxamide
2AMINO1(2FLUOROPHENYL)77DIMETHYL4(3NITROPHENYL)5OXON(13THIAZOL2YL)68DIHYDRO4HQUINOLINE3CARBOXAMIDE
CC1(CC2=C(C(C(=C(N2C3=CC=CC=C3F)N)C(=O)NC4=NC=CS4)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C1)C
InChI=1SC27H24FN5O4Sc127(2)131922(20(34)1427)21(1565716(1215)33(36)37)23(25(35)31263010113826)24(29)32(19)18943817(18)28h31221H131429H212H3(H303135)
MFCD06017372
O=C(C1=C(N)N(C2=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)CC(C2)(C)C)c1ccccc1F)Nc1nccs1
ZINC000098008045
ZINC000098008046
Check stock
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