Vitas-M small molecule compound

(5-methylidene-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)[4-(pyrrolidin-1-ylsulfonyl)phenyl]methanone

Catalog ID
STK571361
SMILES O=C(N1CCc2c(C1=C)cc1c(c2)OCO1)c1ccc(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 C22H22N2O5S MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5S/c1-15-19-13-21-20(28-14-29-21)12-17(19)8-11-24(15)22(25)16-4-6-18(7-5-16)30(26,27)23-9-2-3-10-23/h4-7,12-13H,1-3,8-11,14H2
InChIKey
GOTDJGGZRIPBLQ-UHFFFAOYSA-N
Synonyms
883959-06-6
(5methylene78dihydro(13)dioxolo(45g)isoquinolin6(5H)yl)(4(pyrrolidin1ylsulfonyl)phenyl)methanone
(5methylidene78dihydro(13)dioxolo(45g)isoquinolin6(5H)yl)(4(pyrrolidin1ylsulfonyl)phenyl)methanone
(5METHYLIDENE78DIHYDRO(13)DIOXOLO(45G)ISOQUINOLIN6YL)(4PYRROLIDIN1YLSULFONYLPHENYL)METHANONE
883959066
C=C1C2=CC3=C(C=C2CCN1C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5)OCO3
InChI=1SC22H22N2O5Sc11519132120(28142921)1217(19)81124(15)22(25)164618(7516)30(2627)239231023h471213H1381114H2
MFCD06788488
ZINC000009347961
ZINC09347961
ZINC9347961

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Available files

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