Vitas-M small molecule compound
(1S,5R)-3-[(2-methyl-4-phenyl-1,3-thiazol-5-yl)carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL578733
SMILES Cc1nc(c(s1)C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)c1ccccc1
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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 C22H21N3O2S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2S/c1-14-23-20(16-6-3-2-4-7-16)21(28-14)22(27)24-11-15-10-17(13-24)18-8-5-9-19(26)25(18)12-15/h2-9,15,17H,10-13H2,1H3/t15-,17+/m0/s1InChIKey
DEVGDKXDTDIEIR-DOTOQJQBSA-NSynonyms
(1R5S)3(2methyl4phenylthiazole5carbonyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3((2methyl4phenyl13thiazol5yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
Cc1nc(c(s1)C(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)c1ccccc1
InChI=1SC22H21N3O2Sc1142320(166324716)21(2814)22(27)2411151017(1324)1885919(26)25(18)1215h291517H1013H21H3t1517+m0s1
MFCD33397189
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