Vitas-M small molecule compound

3-chloro-N-{[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide

Catalog ID
STK050815
SMILES S=C(NC(=O)c1cccc(c1)Cl)Nc1ccc(c(c1)c1oc2c(n1)cc(c(c2)C)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 C23H17Cl2N3O2S MW 470.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17Cl2N3O2S/c1-12-8-19-20(9-13(12)2)30-22(27-19)17-11-16(6-7-18(17)25)26-23(31)28-21(29)14-4-3-5-15(24)10-14/h3-11H,1-2H3,(H2,26,28,29,31)
InChIKey
IJVDAQRDUMMXIM-UHFFFAOYSA-N
Synonyms

3CHLORON((4CHLORO3(56DIMETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC2=C(C=C1C)OC(=N2)C3=C(C=CC(=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Cl)Cl
InChI=1SC23H17Cl2N3O2Sc11281920(913(12)2)3022(2719)171116(6718(17)25)2623(31)2821(29)1443515(24)1014h311H12H3(H226282931)
MFCD02628626
S=C(NC(=O)c1cccc(c1)Cl)Nc1ccc(c(c1)c1oc2c(n1)cc(c(c2)C)C)Cl
STK050815
ZINC000002979613
ZINC02979613
ZINC2979613

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Available files

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