Vitas-M small molecule compound
3-(9,10-dimethoxy-5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-(2-methoxyethyl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]propanamide
Catalog ID
STL578647
SMILES COCCN(C(=O)CCN1C(=O)c2ccccc2N2C1c1ccc(c(c1C2=O)OC)OC)C[C@@H]1CCCN2[C@@H]1CCCC2
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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 C33H42N4O6 MW 590.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H42N4O6/c1-41-20-19-35(21-22-9-8-17-34-16-7-6-11-25(22)34)28(38)15-18-36-31-24-13-14-27(42-2)30(43-3)29(24)33(40)37(31)26-12-5-4-10-23(26)32(36)39/h4-5,10,12-14,22,25,31H,6-9,11,15-21H2,1-3H3/t22-,25+,31?/m0/s1InChIKey
JPYAWLAHXCJTSN-IYAZVJMJSA-NSynonyms
3(910dimethoxy511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)N(2methoxyethyl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)propanamide
3(910dimethoxy511dioxoisoindolo(21a)quinazolin6(5H6aH11H)yl)N(2methoxyethyl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)propanamide
COCCN(C(=O)CCN1C(=O)c2ccccc2N2C1c1ccc(c(c1C2=O)OC)OC)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC33H42N4O6c141201935(212298173416761125(22)34)28(38)1518363124131427(422)30(433)29(24)33(40)37(31)2612541023(26)32(36)39h45101214222531H69111521H213H3t2225+31?m0s1
MFCD33397114
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