Vitas-M small molecule compound
7-(4-acetylpiperazin-1-yl)-1-cyclopropyl-6-fluoro-4-oxo-N-[(2Z)-1,3,4-thiadiazol-2(3H)-ylidene]-1,4-dihydroquinoline-3-carboxamide
Catalog ID
STK928094
SMILES O=C(c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)C)F)/N=c/1\scn[nH]1
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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 C21H21FN6O3S MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN6O3S/c1-12(29)26-4-6-27(7-5-26)18-9-17-14(8-16(18)22)19(30)15(10-28(17)13-2-3-13)20(31)24-21-25-23-11-32-21/h8-11,13H,2-7H2,1H3,(H,24,25,31)InChIKey
SJFCHPOBKOKTFX-UHFFFAOYSA-NSynonyms
1092326-34-5(7(4ACETYLPIPERAZINYL)1CYCLOPROPYL6FLUORO4OXO(3HYDROQUINOLYL))N(134THIADIAZOL2YL)CARBOXAMIDE
1092326345
7(4ACETYLPIPERAZIN1YL)1CYCLOPROPYL6FLUORO4OXO14DIHYDROQUINOLINE3CARBOXYLICACID(134)THIADIAZOL2YLAMIDE
7(4acetylpiperazin1yl)1cyclopropyl6fluoro4oxoN((2Z)134thiadiazol2(3H)ylidene)14dihydroquinoline3carboxamide
7(4acetylpiperazin1yl)1cyclopropyl6fluoro4oxoN(134thiadiazol2yl)quinoline3carboxamide
CC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)NC4=NN=CS4)C5CC5)F
InChI=1SC21H21FN6O3Sc112(29)264627(7526)1891714(816(18)22)19(30)15(1028(17)132313)20(31)24212523113221h81113H27H21H3(H242531)
MFCD18175996
O=C(c1cn(C2CC2)c2c(c1=O)cc(c(c2)N1CCN(CC1)C(=O)C)F)N=c1scn(nH)1
ZINC000032616681
ZINC32616681
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.