Vitas-M small molecule compound

7-methyl-8-[(4-methylphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline

Catalog ID
STK574513
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

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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 C20H23NO4S MW 373.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO4S/c1-14-4-6-17(7-5-14)26(22,23)21-9-8-16-12-19-20(13-18(16)15(21)2)25-11-3-10-24-19/h4-7,12-13,15H,3,8-11H2,1-2H3
InChIKey
CAQLBZIBOZJQKO-UHFFFAOYSA-N
Synonyms
883950-62-7
7methyl8((4methylphenyl)sulfonyl)3478910hexahydro2H(14)dioxepino(23g)isoquinoline
7methyl8(4methylphenyl)sulfonyl2347910hexahydro(14)dioxepino(23g)isoquinoline
7methyl8tosyl3478910hexahydro2H(14)dioxepino(23g)isoquinoline
883950627
CC1C2=CC3=C(C=C2CCN1S(=O)(=O)C4=CC=C(C=C4)C)OCCCO3
InChI=1SC20H23NO4Sc1144617(7514)26(2223)219816121920(1318(16)15(21)2)25113102419h47121315H3811H212H3
MFCD07640108
ZINC000005429357
ZINC000005429360

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Available files

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