Vitas-M small molecule compound
N-[1-(1H-benzimidazol-2-yl)-2-phenylethyl]-2-[4-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)tetrahydro-2H-thiopyran-4-yl]acetamide
Catalog ID
STL559509
SMILES Cc1cc(=O)c(c(o1)C1(CCSCC1)CC(=O)NC(c1nc2c([nH]1)cccc2)Cc1ccccc1)O
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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 C28H29N3O4S MW 503.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S/c1-18-15-23(32)25(34)26(35-18)28(11-13-36-14-12-28)17-24(33)29-22(16-19-7-3-2-4-8-19)27-30-20-9-5-6-10-21(20)31-27/h2-10,15,22,34H,11-14,16-17H2,1H3,(H,29,33)(H,30,31)InChIKey
VOPCKMRRTKEPKG-UHFFFAOYSA-NSynonyms
(S)N(1(1Hbenzo(d)imidazol2yl)2phenylethyl)2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)acetamide
139029818
Cc1cc(=O)c(c(o1)C1(CCSCC1)CC(=O)N(C@H)(c1nc2c((nH)1)cccc2)Cc1ccccc1)O
InChI=1SC28H29N3O4Sc1181523(32)25(34)26(3518)28(111336141228)1724(33)2922(16197324819)2730209561021(20)3127h210152234H11141617H21H3(H2933)(H3031)
MFCD32221353
N(1(1Hbenzimidazol2yl)2phenylethyl)2(4(3hydroxy6methyl4oxo4Hpyran2yl)tetrahydro2Hthiopyran4yl)acetamide
N(1(1Hbenzimidazol2yl)2phenylethyl)2(4(3hydroxy6methyl4oxopyran2yl)thian4yl)acetamide
ZINC001776111874
ZINC001776111875
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