Vitas-M small molecule compound

(1S,5S)-3-[2-(ethylsulfonyl)ethyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL526340
SMILES CCS(=O)(=O)CCN1C[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 C15H22N2O3S MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H22N2O3S/c1-2-21(19,20)7-6-16-9-12-8-13(11-16)14-4-3-5-15(18)17(14)10-12/h3-5,12-13H,2,6-11H2,1H3/t12-,13-/m0/s1
InChIKey
ZELKQJIDYHTNBE-STQMWFEESA-N
Synonyms

(1~(S)9~(S))11(2ethylsulfonylethyl)711diazatricyclo(7310^(27))trideca24dien6one
(1R5S)3(2(ethylsulfonyl)ethyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)onehydrochloride
(1S5S)3(2(ethylsulfonyl)ethyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
1426805
CCS(=O)(=O)CCN1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1Cl
InChI=1SC15H22N2O3Sc1221(1920)7616912813(1116)1443515(18)17(14)1012h351213H2611H21H3t1213m0s1
MFCD02925010
ZINC000001321749
ZINC1321749

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Available files

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