Vitas-M small molecule compound
N-{[3-methoxy-4-(pentanoylamino)phenyl]carbamothioyl}-3-methylbenzamide
Catalog ID
STK234104
SMILES CCCCC(=O)Nc1ccc(cc1OC)NC(=S)NC(=O)c1cccc(c1)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 C21H25N3O3S MW 399.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O3S/c1-4-5-9-19(25)23-17-11-10-16(13-18(17)27-3)22-21(28)24-20(26)15-8-6-7-14(2)12-15/h6-8,10-13H,4-5,9H2,1-3H3,(H,23,25)(H2,22,24,26,28)InChIKey
JJVWQCTXZLOSQG-UHFFFAOYSA-NSynonyms
CCCCC(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)C)OC
InChI=1SC21H25N3O3Sc145919(25)2317111016(1318(17)273)2221(28)2420(26)1586714(2)1215h681013H459H213H3(H2325)(H222242628)
MFCD03561090
N((3methoxy4(pentanoylamino)phenyl)carbamothioyl)3methylbenzamide
ZINC000004881637
ZINC04881637
ZINC4881637
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