Vitas-M small molecule compound
2-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-7-fluoro-1-(4-methoxyphenyl)-1,2-dihydrochromeno[2,3-c]pyrrole-3,9-dione
Catalog ID
STK882023
SMILES COc1ccc(cc1)C1N(c2nnc(s2)SCc2ccccc2)C(=O)c2c1c(=O)c1c(o2)ccc(c1)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 C27H18FN3O4S2 MW 531.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18FN3O4S2/c1-34-18-10-7-16(8-11-18)22-21-23(32)19-13-17(28)9-12-20(19)35-24(21)25(33)31(22)26-29-30-27(37-26)36-14-15-5-3-2-4-6-15/h2-13,22H,14H2,1H3InChIKey
SDLHEOCZSSXRIU-UHFFFAOYSA-NSynonyms
2(5(benzylsulfanyl)134thiadiazol2yl)7fluoro1(4methoxyphenyl)12dihydrochromeno(23c)pyrrole39dione
2(5benzylsulfanyl134thiadiazol2yl)7fluoro1(4methoxyphenyl)1Hchromeno(23c)pyrrole39dione
COC1=CC=C(C=C1)C2C3=C(C(=O)N2C4=NN=C(S4)SCC5=CC=CC=C5)OC6=C(C3=O)C=C(C=C6)F
InChI=1SC27H18FN3O4S2c1341810716(81118)222123(32)191317(28)91220(19)3524(21)25(33)31(22)26293027(3726)3614155324615h21322H14H21H3
MFCD06645931
ZINC000098046941
ZINC000098046942
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