Vitas-M small molecule compound
3-(3-nitrophenyl)-2-(phenylsulfonyl)-1,2,3,5,6,10b-hexahydroimidazo[5,1-a]isoquinoline
Catalog ID
STK766135
SMILES [O-][N+](=O)c1cccc(c1)C1N2CCc3c(C2CN1S(=O)(=O)c1ccccc1)cccc3
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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 C23H21N3O4S MW 435.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O4S/c27-26(28)19-9-6-8-18(15-19)23-24-14-13-17-7-4-5-12-21(17)22(24)16-25(23)31(29,30)20-10-2-1-3-11-20/h1-12,15,22-23H,13-14,16H2InChIKey
BBJPPDOLVXDEKW-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cccc(c1)C1N2CCc3c(C2CN1S(=O)(=O)c1ccccc1)cccc3
2(benzenesulfonyl)3(3nitrophenyl)35610btetrahydro1Himidazo(51a)isoquinoline
3(3nitrophenyl)2(phenylsulfonyl)1235610bhexahydroimidazo(51a)isoquinoline
C1CN2C(CN(C2C3=CC(=CC=C3)(N+)(=O)(O))S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C51
InChI=1SC23H21N3O4Sc2726(28)1996818(1519)23241413177451221(17)22(24)1625(23)31(2930)20102131120h112152223H131416H2
MFCD02934796
ZINC000012376833
ZINC000245234484
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