Vitas-M small molecule compound
[1-(4-chloro-3-nitrophenyl)-6-methoxy-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl](phenyl)methanone
Catalog ID
STK782728
SMILES COc1ccc2c(c1)c1CCN(C(c1[nH]2)c1ccc(c(c1)[N+](=O)[O-])Cl)C(=O)c1ccccc1
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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 C25H20ClN3O4 MW 461.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClN3O4/c1-33-17-8-10-21-19(14-17)18-11-12-28(25(30)15-5-3-2-4-6-15)24(23(18)27-21)16-7-9-20(26)22(13-16)29(31)32/h2-10,13-14,24,27H,11-12H2,1H3InChIKey
QELQVBCXTKGWDZ-UHFFFAOYSA-NSynonyms
(1(4chloro3nitrophenyl)6methoxy1349tetrahydro2Hbetacarbolin2yl)(phenyl)methanone
(1(4chloro3nitrophenyl)6methoxy1349tetrahydropyrido(34b)indol2yl)phenylmethanone
COC1=CC2=C(C=C1)NC3=C2CCN(C3C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C(=O)C5=CC=CC=C5
COc1ccc2c(c1)c1CCN(C(c1(nH)2)c1ccc(c(c1)(N+)(=O)(O))Cl)C(=O)c1ccccc1
InChI=1SC25H20ClN3O4c133178102119(1417)18111228(25(30)155324615)24(23(18)2721)167920(26)22(1316)29(31)32h21013142427H1112H21H3
MFCD06616672
ZINC000012371464
ZINC000012371465
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