Vitas-M small molecule compound
2-[(1Z,3R)-5-methyl-2-oxo-1-(3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-7(8H)-ylidene)hexan-3-yl]-1H-isoindole-1,3(2H)-dione
Catalog ID
STK613515
SMILES CC(C[C@@H](N1C(=O)c2c(C1=O)cccc2)C(=O)/C=C/1\NCCc2c1cc1OCCCOc1c2)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 C27H28N2O5 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5/c1-16(2)12-22(29-26(31)18-6-3-4-7-19(18)27(29)32)23(30)15-21-20-14-25-24(33-10-5-11-34-25)13-17(20)8-9-28-21/h3-4,6-7,13-16,22,28H,5,8-12H2,1-2H3/b21-15-/t22-/m1/s1InChIKey
VTHGZUGHFTYBHI-PHCAOYFPSA-NSynonyms
1014063-03-6(SZ)2(5methyl2oxo1(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)hexan3yl)isoindoline13dione
1014063036
2((1Z3R)1(2348910hexahydro(14)dioxepino(23g)isoquinolin7ylidene)5methyl2oxohexan3yl)isoindole13dione
2((1Z3R)5methyl2oxo1(34910tetrahydro2H(14)dioxepino(23g)isoquinolin7(8H)ylidene)hexan3yl)1Hisoindole13(2H)dione
CC(C(C@@H)(N1C(=O)c2c(C1=O)cccc2)C(=O)C=C1NCCc2c1cc1OCCCOc1c2)C
CC(C(C@H)(N1C(=O)c2c(C1=O)cccc2)C(=O)C=C1NCCc2c1cc1OCCCOc1c2)C
CC(C)CC(C(=O)C=C1C2=CC3=C(C=C2CCN1)OCCCO3)N4C(=O)C5=CC=CC=C5C4=O
InChI=1SC27H28N2O5c116(2)1222(2926(31)18634719(18)27(29)32)23(30)152120142524(33105113425)1317(20)892821h346713162228H5812H212H3b2115t22m1s1
MFCD08285759
ZINC000013592768
ZINC13592768
Check stock
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