Vitas-M small molecule compound
2-chloro-4-methyl-N-{[3-(pentanoylamino)phenyl]carbamothioyl}benzamide
Catalog ID
STK234204
SMILES CCCCC(=O)Nc1cccc(c1)NC(=S)NC(=O)c1ccc(cc1Cl)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 C20H22ClN3O2S MW 403.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClN3O2S/c1-3-4-8-18(25)22-14-6-5-7-15(12-14)23-20(27)24-19(26)16-10-9-13(2)11-17(16)21/h5-7,9-12H,3-4,8H2,1-2H3,(H,22,25)(H2,23,24,26,27)InChIKey
KQQOGFFBEKCXNP-UHFFFAOYSA-NSynonyms
2chloro4methylN((3(pentanoylamino)phenyl)carbamothioyl)benzamide
CCCCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)C)Cl
InChI=1SC20H22ClN3O2Sc134818(25)221465715(1214)2320(27)2419(26)1610913(2)1117(16)21h57912H348H212H3(H2225)(H223242627)
MFCD03569259
ZINC000002827910
ZINC02827910
ZINC2827910
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