Vitas-M small molecule compound
2-phenyl-6-[(2Z)-2-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)acetyl]-4,5-dihydropyridazin-3(2H)-one
Catalog ID
STK615591
SMILES O=C1CCC(=NN1c1ccccc1)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 C24H23N3O4 MW 417.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O4/c28-21(19-7-8-24(29)27(26-19)17-5-2-1-3-6-17)15-20-18-14-23-22(30-11-4-12-31-23)13-16(18)9-10-25-20/h1-3,5-6,13-15,25H,4,7-12H2/b20-15-InChIKey
ALVMYTDRSVSGRU-HKWRFOASSA-NSynonyms
903202-61-9(Z)2phenyl6(2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)acetyl)45dihydropyridazin3(2H)one
2phenyl6((2Z)2(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)acetyl)45dihydropyridazin3(2H)one
6((2Z)2(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)acetyl)2phenyl45dihydropyridazin3one
903202619
C1COC2=C(C=C3C(=C2)CCNC3=CC(=O)C4=NN(C(=O)CC4)C5=CC=CC=C5)OC1
InChI=1SC24H23N3O4c2821(197824(29)27(2619)175213617)152018142322(30114123123)1316(18)9102520h1356131525H4712H2b2015
MFCD08287763
O=C1CCC(=NN1c1ccccc1)C(=O)C=C1NCCc2c1cc1OCCCOc1c2
ZINC000100942245
ZINC100942245
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