Vitas-M small molecule compound
(2Z)-1-{4-[(methylsulfanyl)methyl]phenyl}-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanone
Catalog ID
STK600273
SMILES CSCc1ccc(cc1)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2
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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 C22H23NO3S MW 381.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO3S/c1-27-14-15-3-5-16(6-4-15)20(24)13-19-18-12-22-21(25-9-2-10-26-22)11-17(18)7-8-23-19/h3-6,11-13,23H,2,7-10,14H2,1H3/b19-13-InChIKey
PVJUWQMWVHFABZ-UYRXBGFRSA-NSynonyms
892636-72-5(2Z)1(4((methylsulfanyl)methyl)phenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
(2Z)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)1(4(methylsulfanylmethyl)phenyl)ethanone
(Z)1(4((methylthio)methyl)phenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanone
892636725
CSCC1=CC=C(C=C1)C(=O)C=C2C3=CC4=C(C=C3CCN2)OCCCO4
CSCc1ccc(cc1)C(=O)C=C1NCCc2c1cc1OCCCOc1c2
InChI=1SC22H23NO3Sc12714153516(6415)20(24)131918122221(2592102622)1117(18)782319h36111323H271014H21H3b1913
MFCD07639642
ZINC000005428062
ZINC05428062
ZINC5428062
Check stock
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