Vitas-M small molecule compound
3-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Catalog ID
STL131271
SMILES Clc1ccc(cc1)N1CCN(CC1)C(=O)Cn1cnc2c(c1=O)[nH]c1c2cc(cc1)C
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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 C23H22ClN5O2 MW 435.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN5O2/c1-15-2-7-19-18(12-15)21-22(26-19)23(31)29(14-25-21)13-20(30)28-10-8-27(9-11-28)17-5-3-16(24)4-6-17/h2-7,12,14,26H,8-11,13H2,1H3InChIKey
BBKSKKQLHKWMDM-UHFFFAOYSA-NSynonyms
3(2(4(4chlorophenyl)piperazin1yl)2oxoethyl)8methyl35dihydro4Hpyrimido(54b)indol4one
3(2(4(4chlorophenyl)piperazin1yl)2oxoethyl)8methyl5Hpyrimido(54b)indol4one
CC1=CC2=C(C=C1)NC3=C2N=CN(C3=O)CC(=O)N4CCN(CC4)C5=CC=C(C=C5)Cl
Clc1ccc(cc1)N1CCN(CC1)C(=O)Cn1cnc2c(c1=O)(nH)c1c2cc(cc1)C
InChI=1SC23H22ClN5O2c115271918(1215)2122(2619)23(31)29(142521)1320(30)2810827(91128)175316(24)4617h27121426H81113H21H3
MFCD20751242
ZINC000035423525
ZINC35423525
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