Vitas-M small molecule compound
5-chloro-3,6-dimethyl-N-{5-[(3-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1-benzofuran-2-carboxamide
Catalog ID
STK883148
SMILES Cc1cccc(c1)CSc1nnc(s1)NC(=O)c1oc2c(c1C)cc(c(c2)C)Cl
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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 C21H18ClN3O2S2 MW 443.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O2S2/c1-11-5-4-6-14(7-11)10-28-21-25-24-20(29-21)23-19(26)18-13(3)15-9-16(22)12(2)8-17(15)27-18/h4-9H,10H2,1-3H3,(H,23,24,26)InChIKey
LQLWVRDCJDTNJX-UHFFFAOYSA-NSynonyms
5chloro36dimethylN(5((3methylbenzyl)sulfanyl)134thiadiazol2yl)1benzofuran2carboxamide
5CHLORO36DIMETHYLN(5((3METHYLPHENYL)METHYLSULFANYL)134THIADIAZOL2YL)1BENZOFURAN2CARBOXAMIDE
CC1=CC(=CC=C1)CSC2=NN=C(S2)NC(=O)C3=C(C4=CC(=C(C=C4O3)C)Cl)C
InChI=1SC21H18ClN3O2S2c11154614(711)102821252420(2921)2319(26)1813(3)15916(22)12(2)817(15)2718h49H10H213H3(H232426)
MFCD06624231
ZINC000001049499
ZINC01049499
ZINC1049499
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