Vitas-M small molecule compound
6-chloro-N-[(2Z)-5-[(4-fluorobenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-7-methyl-4-oxo-4H-chromene-2-carboxamide
Catalog ID
STK589258
SMILES Fc1ccc(cc1)CSc1n[nH]/c(=N/C(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)/s1
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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 C20H13ClFN3O3S2 MW 461.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClFN3O3S2/c1-10-6-16-13(7-14(10)21)15(26)8-17(28-16)18(27)23-19-24-25-20(30-19)29-9-11-2-4-12(22)5-3-11/h2-8H,9H2,1H3,(H,23,24,27)InChIKey
HKICCHVCKNMWLH-UHFFFAOYSA-NSynonyms
873080-86-56chloroN((2Z)5((4fluorobenzyl)sulfanyl)134thiadiazol2(3H)ylidene)7methyl4oxo4Hchromene2carboxamide
CC1=C(C=C2C(=C1)OC(=CC2=O)C(=O)NC3=NN=C(S3)SCC4=CC=C(C=C4)F)Cl
Fc1ccc(cc1)CSc1n(nH)c(=NC(=O)c2cc(=O)c3c(o2)cc(c(c3)Cl)C)s1
InChI=1SC20H13ClFN3O3S2c11061613(714(10)21)15(26)817(2816)18(27)2319242520(3019)299112412(22)5311h28H9H21H3(H232427)
MFCD07202883
ZINC000009360867
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