Vitas-M small molecule compound
N-[4-(pyrrolidin-1-ylsulfonyl)phenyl]-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)acetamide
Catalog ID
STK580779
SMILES O=C(CN1CCc2c(C1)cc1c(c2)OCCCO1)Nc1ccc(cc1)S(=O)(=O)N1CCCC1
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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 C24H29N3O5S MW 471.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N3O5S/c28-24(25-20-4-6-21(7-5-20)33(29,30)27-9-1-2-10-27)17-26-11-8-18-14-22-23(15-19(18)16-26)32-13-3-12-31-22/h4-7,14-15H,1-3,8-13,16-17H2,(H,25,28)InChIKey
XFEZMWWMLORZDT-UHFFFAOYSA-NSynonyms
883959-56-62(2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)N(4pyrrolidin1ylsulfonylphenyl)acetamide
883959566
C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCC4=CC5=C(C=C4C3)OCCCO5
InChI=1SC24H29N3O5Sc2824(25204621(7520)33(2930)279121027)172611818142223(1519(18)1626)32133123122h471415H138131617H2(H2528)
MFCD06794250
N(4(pyrrolidin1ylsulfonyl)phenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)acetamide
ZINC000009429977
ZINC9429977
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