Vitas-M small molecule compound
N-[2-({[(5-methoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl}amino)ethyl]-4-methylbenzamide
Catalog ID
STK346146
SMILES COc1ccc2c(c1)nc([nH]2)SCC(=O)NCCNC(=O)c1ccc(cc1)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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-13-3-5-14(6-4-13)19(26)22-10-9-21-18(25)12-28-20-23-16-8-7-15(27-2)11-17(16)24-20/h3-8,11H,9-10,12H2,1-2H3,(H,21,25)(H,22,26)(H,23,24)InChIKey
IXVPHVPSJSJVHW-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C(=O)NCCNC(=O)CSC2=NC3=C(N2)C=C(C=C3)OC
COc1ccc2c(c1)nc((nH)2)SCC(=O)NCCNC(=O)c1ccc(cc1)C
InChI=1SC20H22N4O3Sc1133514(6413)19(26)221092118(25)12282023168715(272)1117(16)2420h3811H91012H212H3(H2125)(H2226)(H2324)
MFCD09156674
N(2((((5methoxy1Hbenzimidazol2yl)sulfanyl)acetyl)amino)ethyl)4methylbenzamide
N(2((2((6methoxy1Hbenzimidazol2yl)sulfanyl)acetyl)amino)ethyl)4methylbenzamide
ZINC000010231776
ZINC10231776
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