Vitas-M small molecule compound
3-(5-{[2-chloro-5-(trifluoromethyl)phenyl]amino}-1,3,4-thiadiazol-2-yl)-2H-chromen-2-one
Catalog ID
STK005423
SMILES Clc1ccc(cc1Nc1nnc(s1)c1cc2ccccc2oc1=O)C(F)(F)F
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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 C18H9ClF3N3O2S MW 423.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H9ClF3N3O2S/c19-12-6-5-10(18(20,21)22)8-13(12)23-17-25-24-15(28-17)11-7-9-3-1-2-4-14(9)27-16(11)26/h1-8H,(H,23,25)InChIKey
RCKCJVJMRGCZCY-UHFFFAOYSA-NSynonyms
3(5((2CHLORO5(TRIFLUOROMETHYL)PHENYL)AMINO)134THIADIAZOL2YL)2HCHROMEN2ONE
3(5(2CHLORO5(TRIFLUOROMETHYL)ANILINO)134THIADIAZOL2YL)CHROMEN2ONE
C1=CC=C2C(=C1)C=C(C(=O)O2)C3=NN=C(S3)NC4=C(C=CC(=C4)C(F)(F)F)Cl
Clc1ccc(cc1Nc1nnc(s1)c1cc2ccccc2oc1=O)C(F)(F)F
InChI=1SC18H9ClF3N3O2Sc19126510(18(2021)22)813(12)2317252415(2817)1179312414(9)2716(11)26h18H(H2325)
MFCD02088350
STK005423
ZINC000002956012
ZINC02956012
ZINC2956012
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