Vitas-M small molecule compound
2-iodo-N-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonothioyl}benzamide
Catalog ID
STL553106
SMILES S=C(N1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1)NC(=O)c1ccccc1I
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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 C19H18IN3O2S MW 479.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18IN3O2S/c20-15-5-2-1-4-14(15)18(25)21-19(26)22-9-12-8-13(11-22)16-6-3-7-17(24)23(16)10-12/h1-7,12-13H,8-11H2,(H,21,25,26)/t12-,13?/m0/s1InChIKey
JLKMOJANBJPBNA-UEWDXFNNSA-NSynonyms
135640877
2iodo~(N)((9~(R))6oxo711diazatricyclo(7310^(27))trideca24diene11carbothioyl)benzamide
2iodoN(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonothioyl)benzamide
2iodoN((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carbonothioyl)benzamide
InChI=1SC19H18IN3O2Sc2015521414(15)18(25)2119(26)22912813(1122)1663717(24)23(16)1012h171213H811H2(H212526)t1213?m0s1
S=C(N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)NC(=O)c1ccccc1I
ZINC000016031193
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