Vitas-M small molecule compound
(1S,5S)-3-({1-[(4-methoxyphenyl)sulfonyl]piperidin-4-yl}carbonyl)-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL535225
SMILES COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C24H29N3O5S MW 471.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O5S/c1-32-20-5-7-21(8-6-20)33(30,31)26-11-9-18(10-12-26)24(29)25-14-17-13-19(16-25)22-3-2-4-23(28)27(22)15-17/h2-8,17-19H,9-16H2,1H3/t17-,19+/m0/s1InChIKey
XEKATZAZTWTYBF-PKOBYXMFSA-NSynonyms
(1R5S)3(1((4methoxyphenyl)sulfonyl)piperidine4carbonyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5S)3((1((4methoxyphenyl)sulfonyl)piperidin4yl)carbonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC24H29N3O5Sc132205721(8620)33(3031)2611918(101226)24(29)2514171319(1625)2232423(28)27(22)1517h281719H916H21H3t1719+m0s1
MFCD09843416
ZINC000100789245
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