Vitas-M small molecule compound

3-{5-[(3-chlorophenyl)amino]-1,3,4-thiadiazol-2-yl}-7-(diethylamino)-2H-chromen-2-one

Catalog ID
STK000887
SMILES CCN(c1ccc2c(c1)oc(=O)c(c2)c1nnc(s1)Nc1cccc(c1)Cl)CC

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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 C21H19ClN4O2S MW 426.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O2S/c1-3-26(4-2)16-9-8-13-10-17(20(27)28-18(13)12-16)19-24-25-21(29-19)23-15-7-5-6-14(22)11-15/h5-12H,3-4H2,1-2H3,(H,23,25)
InChIKey
PFOHSTFNHAZOPW-UHFFFAOYSA-N
Synonyms

3(5((3CHLOROPHENYL)AMINO)134THIADIAZOL2YL)7(DIETHYLAMINO)2HCHROMEN2ONE
3(5(3CHLOROANILINO)134THIADIAZOL2YL)7(DIETHYLAMINO)CHROMEN2ONE
CCN(c1ccc2c(c1)oc(=O)c(c2)c1nnc(s1)Nc1cccc(c1)Cl)CC
CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NN=C(S3)NC4=CC(=CC=C4)Cl
InChI=1SC21H19ClN4O2Sc1326(42)1698131017(20(27)2818(13)1216)19242521(2919)231575614(22)1115h512H34H212H3(H2325)
MFCD03032670
STK000887
ZINC000008915957
ZINC08915957
ZINC8915957

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Available files

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