Vitas-M small molecule compound
(2Z)-N-(4-ethoxyphenyl)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)ethanamide
Catalog ID
STK583038
SMILES CCOc1ccc(cc1)NC(=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 C22H24N2O4 MW 380.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4/c1-2-26-17-6-4-16(5-7-17)24-22(25)14-19-18-13-21-20(27-10-3-11-28-21)12-15(18)8-9-23-19/h4-7,12-14,23H,2-3,8-11H2,1H3,(H,24,25)/b19-14-InChIKey
KOJJWQDKYPFPDG-RGEXLXHISA-NSynonyms
898919-87-4(2Z)N(4ethoxyphenyl)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)acetamide
(2Z)N(4ethoxyphenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)ethanamide
(Z)N(4ethoxyphenyl)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)acetamide
898919874
CCOC1=CC=C(C=C1)NC(=O)C=C2C3=CC4=C(C=C3CCN2)OCCCO4
CCOc1ccc(cc1)NC(=O)C=C1NCCc2c1cc1OCCCOc1c2
InChI=1SC22H24N2O4c1226176416(5717)2422(25)141918132120(27103112821)1215(18)892319h47121423H23811H21H3(H2425)b1914
MFCD07641627
ZINC000005452237
ZINC05452237
ZINC5452237
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