Vitas-M small molecule compound
5-{2-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-2-oxoethyl}pyrido[2,3-b][1,4]benzoxazepin-6(5H)-one
Catalog ID
STL407582
SMILES O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)CN1c2cccnc2Oc2c(C1=O)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 C22H24N4O5S MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O5S/c27-20(25-11-9-24(10-12-25)16-7-13-32(29,30)15-16)14-26-18-5-3-8-23-21(18)31-19-6-2-1-4-17(19)22(26)28/h1-6,8,16H,7,9-15H2InChIKey
VNAXVCHMYHOBQU-UHFFFAOYSA-NSynonyms
5(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethyl)benzo(f)pyrido(23b)(14)oxazepin6(5H)one
5(2(4(11dioxidotetrahydrothiophen3yl)piperazin1yl)2oxoethyl)pyrido(23b)(14)benzoxazepin6(5H)one
5(2(4(11dioxothiolan3yl)piperazin1yl)2oxoethyl)pyrido(23b)(14)benzoxazepin6one
C1CS(=O)(=O)CC1N2CCN(CC2)C(=O)CN3C4=C(N=CC=C4)OC5=CC=CC=C5C3=O
InChI=1SC22H24N4O5Sc2720(2511924(101225)1671332(2930)1516)1426185382321(18)3119621417(19)22(26)28h16816H7915H2
MFCD30704814
ZINC000101367049
ZINC000101367051
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