Vitas-M small molecule compound
[1-(4-chloro-3-nitrophenyl)-6-methoxy-1,3,4,9-tetrahydro-2H-beta-carbolin-2-yl](3-methoxyphenyl)methanone
Catalog ID
STK783555
SMILES COc1cccc(c1)C(=O)N1CCc2c(C1c1ccc(c(c1)[N+](=O)[O-])Cl)[nH]c1c2cc(cc1)OC
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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 C26H22ClN3O5 MW 491.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN3O5/c1-34-17-5-3-4-16(12-17)26(31)29-11-10-19-20-14-18(35-2)7-9-22(20)28-24(19)25(29)15-6-8-21(27)23(13-15)30(32)33/h3-9,12-14,25,28H,10-11H2,1-2H3InChIKey
NBBSSZJPIQQOHE-UHFFFAOYSA-NSynonyms
(1(4chloro3nitrophenyl)6methoxy1349tetrahydro2Hbetacarbolin2yl)(3methoxyphenyl)methanone
(1(4chloro3nitrophenyl)6methoxy1349tetrahydropyrido(34b)indol2yl)(3methoxyphenyl)methanone
COC1=CC2=C(C=C1)NC3=C2CCN(C3C4=CC(=C(C=C4)Cl)(N+)(=O)(O))C(=O)C5=CC(=CC=C5)OC
COc1cccc(c1)C(=O)N1CCc2c(C1c1ccc(c(c1)(N+)(=O)(O))Cl)(nH)c1c2cc(cc1)OC
InChI=1SC26H22ClN3O5c1341753416(1217)26(31)29111019201418(352)7922(20)2824(19)25(29)156821(27)23(1315)30(32)33h3912142528H1011H212H3
MFCD06618417
ZINC000012371530
ZINC000012371531
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