Vitas-M small molecule compound
N-{4-[(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)sulfonyl]phenyl}acetamide
Catalog ID
STK583587
SMILES CC(=O)Nc1ccc(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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-14-19-13-21-20(27-10-3-11-28-21)12-16(19)8-9-23(14)29(25,26)18-6-4-17(5-7-18)22-15(2)24/h4-7,12-14H,3,8-11H2,1-2H3,(H,22,24)InChIKey
SISLJBTWXMPNDL-UHFFFAOYSA-NSynonyms
883950-64-9883950649
CC1C2=CC3=C(C=C2CCN1S(=O)(=O)C4=CC=C(C=C4)NC(=O)C)OCCCO3
InChI=1SC21H24N2O5Sc11419132120(27103112821)1216(19)8923(14)29(2526)186417(5718)2215(2)24h471214H3811H212H3(H2224)
MFCD07638414
N(4((7methyl2347910hexahydro(14)dioxepino(23g)isoquinolin8yl)sulfonyl)phenyl)acetamide
N(4((7methyl34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)sulfonyl)phenyl)acetamide
ZINC000005354901
ZINC000005354905
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