Vitas-M small molecule compound
3-chloro-N-{[4-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide
Catalog ID
STK013600
SMILES S=C(NC(=O)c1cccc(c1)Cl)Nc1ccc(cc1)c1oc2c(n1)cc(c(c2)C)C
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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 C23H18ClN3O2S MW 435.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClN3O2S/c1-13-10-19-20(11-14(13)2)29-22(26-19)15-6-8-18(9-7-15)25-23(30)27-21(28)16-4-3-5-17(24)12-16/h3-12H,1-2H3,(H2,25,27,28,30)InChIKey
CXYCPBXGDIETFE-UHFFFAOYSA-NSynonyms
3CHLORON((4(56DIMETHYL13BENZOXAZOL2YL)PHENYL)CARBAMOTHIOYL)BENZAMIDE
CC1=CC2=C(C=C1C)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC(=CC=C4)Cl
InChI=1SC23H18ClN3O2Sc113101920(1114(13)2)2922(2619)156818(9715)2523(30)2721(28)1643517(24)1216h312H12H3(H225272830)
MFCD02628598
S=C(NC(=O)c1cccc(c1)Cl)Nc1ccc(cc1)c1oc2c(n1)cc(c(c2)C)C
STK013600
ZINC000002982649
ZINC02982649
ZINC2982649
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