Vitas-M small molecule compound
3-(4-chlorophenyl)-1-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-4-(1H-pyrrol-1-yl)butan-1-one
Catalog ID
STL492483
SMILES Clc1ccc(cc1)C(CC(=O)N1CCC2(C(C1)CCCC2)O)Cn1cccc1
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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 C23H29ClN2O2 MW 400.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29ClN2O2/c24-21-8-6-18(7-9-21)19(16-25-12-3-4-13-25)15-22(27)26-14-11-23(28)10-2-1-5-20(23)17-26/h3-4,6-9,12-13,19-20,28H,1-2,5,10-11,14-17H2InChIKey
YQRNLBUKJUVSIF-UHFFFAOYSA-NSynonyms
1(4ahydroxy13456788aoctahydroisoquinolin2yl)3(4chlorophenyl)4pyrrol1ylbutan1one
3(4chlorophenyl)1(4ahydroxyoctahydroisoquinolin2(1H)yl)4(1Hpyrrol1yl)butan1one
C1CCC2(CCN(CC2C1)C(=O)CC(CN3C=CC=C3)C4=CC=C(C=C4)Cl)O
InChI=1SC23H29ClN2O2c24218618(7921)19(162512341325)1522(27)26141123(28)1021520(23)1726h34691213192028H12510111417H2
MFCD29058419
ZINC000253414800
ZINC000253414803
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