Vitas-M small molecule compound
(1S,5S)-3-[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL526442
SMILES Cc1oc2c(c1C(=O)N1C[C@H]3C[C@@H](C1)c1n(C3)c(=O)ccc1)CCCC2
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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 C21H24N2O3 MW 352.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3/c1-13-20(16-5-2-3-7-18(16)26-13)21(25)22-10-14-9-15(12-22)17-6-4-8-19(24)23(17)11-14/h4,6,8,14-15H,2-3,5,7,9-12H2,1H3/t14-,15-/m0/s1InChIKey
UZUOKHUWMJRQRL-GJZGRUSLSA-NSynonyms
1212109-01-7(1~(S)9~(S))11(2methyl4567tetrahydro1benzofuran3carbonyl)711diazatricyclo(7310^(27))trideca24dien6one
(1R5S)3(2methyl4567tetrahydrobenzofuran3carbonyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5S)3((2methyl4567tetrahydro1benzofuran3yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
1212109017
16397322
Cc1oc2c(c1C(=O)N1C(C@@H)3C(C@H)(C1)c1n(C3)c(=O)ccc1)CCCC2
InChI=1SC21H24N2O3c11320(16523718(16)2613)21(25)221014915(1222)1764819(24)23(17)1114h4681415H2357912H21H3t1415m0s1
MFCD02925915
ZINC000100745781
ZINC100745781
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