Vitas-M small molecule compound
4-chloro-N-{[5-(5,7-dichloro-1,3-benzoxazol-2-yl)-2-methylphenyl]carbamothioyl}benzamide
Catalog ID
STK055718
SMILES S=C(Nc1cc(ccc1C)c1oc2c(n1)cc(cc2Cl)Cl)NC(=O)c1ccc(cc1)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 C22H14Cl3N3O2S MW 490.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14Cl3N3O2S/c1-11-2-3-13(21-26-18-10-15(24)9-16(25)19(18)30-21)8-17(11)27-22(31)28-20(29)12-4-6-14(23)7-5-12/h2-10H,1H3,(H2,27,28,29,31)InChIKey
NKIWEOHAJYDXAZ-UHFFFAOYSA-NSynonyms
4CHLORON((5(57DICHLORO13BENZOXAZOL2YL)2METHYLPHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=C(C=C(C=C1)C2=NC3=CC(=CC(=C3O2)Cl)Cl)NC(=S)NC(=O)C4=CC=C(C=C4)Cl
InChI=1SC22H14Cl3N3O2Sc1112313(2126181015(24)916(25)19(18)3021)817(11)2722(31)2820(29)124614(23)7512h210H1H3(H227282931)
MFCD02630083
S=C(Nc1cc(ccc1C)c1oc2c(n1)cc(cc2Cl)Cl)NC(=O)c1ccc(cc1)Cl
STK055718
ZINC000002978740
ZINC02978740
ZINC2978740
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