Vitas-M small molecule compound
7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-N-[(2E)-5-methyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Catalog ID
STK562918
SMILES Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)/N=c/1\[nH]nc(s1)C
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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 C27H24ClFN6O3S MW 567.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24ClFN6O3S/c1-15-31-32-27(39-15)30-25(37)20-14-35(18-5-6-18)22-13-23(21(29)12-19(22)24(20)36)33-7-9-34(10-8-33)26(38)16-3-2-4-17(28)11-16/h2-4,11-14,18H,5-10H2,1H3,(H,30,32,37)InChIKey
JHWUYHXVWLCDRO-UHFFFAOYSA-NSynonyms
7(4((3chlorophenyl)carbonyl)piperazin1yl)1cyclopropyl6fluoroN((2E)5methyl134thiadiazol2(3H)ylidene)4oxo14dihydroquinoline3carboxamide
7(4(3CHLOROBENZOYL)PIPERAZIN1YL)1CYCLOPROPYL6FLUORON(5METHYL134THIADIAZOL2YL)4OXOQUINOLINE3CARBOXAMIDE
CC1=NN=C(S1)NC(=O)C2=CN(C3=CC(=C(C=C3C2=O)F)N4CCN(CC4)C(=O)C5=CC(=CC=C5)Cl)C6CC6
Clc1cccc(c1)C(=O)N1CCN(CC1)c1cc2c(cc1F)c(=O)c(cn2C1CC1)C(=O)N=c1(nH)nc(s1)C
InChI=1SC27H24ClFN6O3Sc115313227(3915)3025(37)201435(185618)221323(21(29)1219(22)24(20)36)337934(10833)26(38)1632417(28)1116h24111418H510H21H3(H303237)
MFCD04072833
ZINC000001838365
ZINC01838365
ZINC1838365
Check stock
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Check stock on Vitas-MAvailable files
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