Vitas-M small molecule compound
3-bromo-N-{[3-methoxy-4-(pentanoylamino)phenyl]carbamothioyl}benzamide
Catalog ID
STK234117
SMILES CCCCC(=O)Nc1ccc(cc1OC)NC(=S)NC(=O)c1cccc(c1)Br
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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 C20H22BrN3O3S MW 464.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrN3O3S/c1-3-4-8-18(25)23-16-10-9-15(12-17(16)27-2)22-20(28)24-19(26)13-6-5-7-14(21)11-13/h5-7,9-12H,3-4,8H2,1-2H3,(H,23,25)(H2,22,24,26,28)InChIKey
KRTNVHYAWYKEFY-UHFFFAOYSA-NSynonyms
3bromoN((3methoxy4(pentanoylamino)phenyl)carbamothioyl)benzamide
CCCCC(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)Br)OC
InChI=1SC20H22BrN3O3Sc134818(25)231610915(1217(16)272)2220(28)2419(26)1365714(21)1113h57912H348H212H3(H2325)(H222242628)
MFCD03563482
ZINC000002820756
ZINC02820756
ZINC2820756
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