Vitas-M small molecule compound
2-(2,5-dimethylphenyl)-6-[(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)carbonyl]-4,5-dihydropyridazin-3(2H)-one
Catalog ID
STK612867
SMILES Cc1ccc(c(c1)N1N=C(CCC1=O)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1)C
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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 C26H29N3O4 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O4/c1-16-5-6-17(2)22(13-16)29-25(30)8-7-21(27-29)26(31)28-10-9-19-14-23-24(15-20(19)18(28)3)33-12-4-11-32-23/h5-6,13-15,18H,4,7-12H2,1-3H3InChIKey
UCFVAKGNRXULNF-UHFFFAOYSA-NSynonyms
903850-65-72(25dimethylphenyl)6((7methyl34910tetrahydro2H(14)dioxepino(23g)isoquinolin8(7H)yl)carbonyl)45dihydropyridazin3(2H)one
2(25dimethylphenyl)6(7methyl2347910hexahydro(14)dioxepino(23g)isoquinoline8carbonyl)45dihydropyridazin3one
2(25dimethylphenyl)6(7methyl3478910hexahydro2H(14)dioxepino(23g)isoquinoline8carbonyl)45dihydropyridazin3(2H)one
903850657
CC1C2=CC3=C(C=C2CCN1C(=O)C4=NN(C(=O)CC4)C5=C(C=CC(=C5)C)C)OCCCO3
InChI=1SC26H29N3O4c1165617(2)22(1316)2925(30)8721(2729)26(31)2810919142324(1520(19)18(28)3)33124113223h56131518H4712H213H3
MFCD08286337
ZINC000013593240
ZINC000013593243
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