Vitas-M small molecule compound
3-(1,3-benzothiazol-2-yl)-4-oxo-4H-chromen-7-yl 4-chlorobutanoate
Catalog ID
STK844445
SMILES ClCCCC(=O)Oc1ccc2c(c1)occ(c2=O)c1nc2c(s1)cccc2
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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 C20H14ClNO4S MW 399.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14ClNO4S/c21-9-3-6-18(23)26-12-7-8-13-16(10-12)25-11-14(19(13)24)20-22-15-4-1-2-5-17(15)27-20/h1-2,4-5,7-8,10-11H,3,6,9H2InChIKey
FITXLJCONWMQCQ-UHFFFAOYSA-NSynonyms
637746-60-2(3(13BENZOTHIAZOL2YL)4OXOCHROMEN7YL)4CHLOROBUTANOATE
3(13benzothiazol2yl)4oxo4Hchromen7yl4chlorobutanoate
3(BENZO(D)THIAZOL2YL)4OXO4HCHROMEN7YL4CHLOROBUTANOATE
3BENZOTHIAZOL2YL4OXOCHROMEN7YL4CHLOROBUTANOATE
637746602
C1=CC=C2C(=C1)N=C(S2)C3=COC4=C(C3=O)C=CC(=C4)OC(=O)CCCCl
InChI=1SC20H14ClNO4Sc2193618(23)2612781316(1012)251114(19(13)24)202215412517(15)2720h1245781011H369H2
MFCD03671222
ZINC000002203533
ZINC02203533
ZINC2203533
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