Vitas-M small molecule compound
2-(3-benzyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
Catalog ID
STL145455
SMILES O=C(Cn1c2ccccc2c2c1c(=O)n(cn2)Cc1ccccc1)Nc1ccc2c(c1)OCCO2
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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 C27H22N4O4 MW 466.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N4O4/c32-24(29-19-10-11-22-23(14-19)35-13-12-34-22)16-31-21-9-5-4-8-20(21)25-26(31)27(33)30(17-28-25)15-18-6-2-1-3-7-18/h1-11,14,17H,12-13,15-16H2,(H,29,32)InChIKey
OCVFDSDDOGCDIU-UHFFFAOYSA-NSynonyms
1189464-35-41189464354
2(3benzyl4oxo34dihydro5Hpyrimido(54b)indol5yl)N(23dihydro14benzodioxin6yl)acetamide
2(3benzyl4oxopyrimido(54b)indol5yl)N(23dihydro14benzodioxin6yl)acetamide
C1COC2=C(O1)C=CC(=C2)NC(=O)CN3C4=CC=CC=C4C5=C3C(=O)N(C=N5)CC6=CC=CC=C6
InChI=1SC27H22N4O4c3224(291910112223(1419)3513123422)163121954820(21)2526(31)27(33)30(172825)15186213718h1111417H12131516H2(H2932)
MFCD20754955
ZINC000035399655
ZINC35399655
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