Vitas-M small molecule compound
2-amino-1-(4-fluorophenyl)-4-(3-nitrophenyl)-5-oxo-N-(1,3-thiazol-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STK686743
SMILES Fc1ccc(cc1)N1C(=C(C(=O)Nc2nccs2)C(C2=C1CCCC2=O)c1cccc(c1)[N+](=O)[O-])N
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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 C25H20FN5O4S MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5O4S/c26-15-7-9-16(10-8-15)30-18-5-2-6-19(32)21(18)20(14-3-1-4-17(13-14)31(34)35)22(23(30)27)24(33)29-25-28-11-12-36-25/h1,3-4,7-13,20H,2,5-6,27H2,(H,28,29,33)InChIKey
JDHQCNRNZRWRBD-UHFFFAOYSA-NSynonyms
2amino1(4fluorophenyl)4(3nitrophenyl)5oxoN(13thiazol2yl)145678hexahydroquinoline3carboxamide
2amino1(4fluorophenyl)4(3nitrophenyl)5oxoN(13thiazol2yl)4678tetrahydroquinoline3carboxamide
C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)F)N)C(=O)NC4=NC=CS4)C5=CC(=CC=C5)(N+)(=O)(O))C(=O)C1
Fc1ccc(cc1)N1C(=C(C(=O)Nc2nccs2)C(C2=C1CCCC2=O)c1cccc(c1)(N+)(=O)(O))N
InChI=1SC25H20FN5O4Sc26157916(10815)301852619(32)21(18)20(1431417(1314)31(34)35)22(23(30)27)24(33)29252811123625h13471320H25627H2(H282933)
MFCD06017383
ZINC000012428884
ZINC000012428885
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