Vitas-M small molecule compound
3-chloro-N-{[3-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK033060
SMILES S=C(NC(=O)c1cccc(c1)Cl)Nc1cccc(c1)c1oc2c(n1)cc(cc2)Cl
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H13Cl2N3O2S MW 442.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2N3O2S/c22-14-5-1-3-12(9-14)19(27)26-21(29)24-16-6-2-4-13(10-16)20-25-17-11-15(23)7-8-18(17)28-20/h1-11H,(H2,24,26,27,29)InChIKey
FCMOXURDUSWETM-UHFFFAOYSA-NSynonyms
347333-34-0347333340
3CHLORON((3(5CHLORO13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
3chloroN((3(5chlorobenzo(d)oxazol2yl)phenyl)carbamothioyl)benzamide
C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC(=CC=C2)Cl)C3=NC4=C(O3)C=CC(=C4)Cl
InChI=1SC21H13Cl2N3O2Sc221451312(914)19(27)2621(29)241662413(1016)2025171115(23)7818(17)2820h111H(H224262729)
MFCD02628631
S=C(NC(=O)c1cccc(c1)Cl)Nc1cccc(c1)c1oc2c(n1)cc(cc2)Cl
STK033060
ZINC000002260249
ZINC02260249
ZINC2260249
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