Vitas-M small molecule compound
N-[4-methyl-3-(morpholin-4-ylsulfonyl)phenyl]-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Catalog ID
STK590888
SMILES O=C(Nc1ccc(c(c1)S(=O)(=O)N1CCOCC1)C)CN1CCc2c(C1)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 C25H31N3O6S MW 501.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O6S/c1-18-3-4-21(15-24(18)35(30,31)28-7-11-32-12-8-28)26-25(29)17-27-6-5-19-13-22-23(14-20(19)16-27)34-10-2-9-33-22/h3-4,13-15H,2,5-12,16-17H2,1H3,(H,26,29)InChIKey
FKKIIYMVLHCIPO-UHFFFAOYSA-NSynonyms
883959-42-02(2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)N(4methyl3morpholin4ylsulfonylphenyl)acetamide
883959420
CC1=C(C=C(C=C1)NC(=O)CN2CCC3=CC4=C(C=C3C2)OCCCO4)S(=O)(=O)N5CCOCC5
InChI=1SC25H31N3O6Sc1183421(1524(18)35(3031)287113212828)2625(29)17276519132223(1420(19)1627)3410293322h341315H25121617H21H3(H2629)
MFCD06790612
N(4methyl3(morpholin4ylsulfonyl)phenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)acetamide
N(4methyl3(morpholinosulfonyl)phenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)acetamide
ZINC000009348683
ZINC9348683
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