Vitas-M small molecule compound
2,4-dichloro-N-{(1Z)-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxo-1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]prop-1-en-2-yl}benzamide
Catalog ID
STK873210
SMILES Clc1ccc(c(c1)Cl)C(=O)N/C(=C\c1cn(nc1c1cccs1)c1ccccc1)/C(=O)NCCCN1CCOCC1
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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 C30H29Cl2N5O3S MW 610.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29Cl2N5O3S/c31-22-9-10-24(25(32)19-22)29(38)34-26(30(39)33-11-5-12-36-13-15-40-16-14-36)18-21-20-37(23-6-2-1-3-7-23)35-28(21)27-8-4-17-41-27/h1-4,6-10,17-20H,5,11-16H2,(H,33,39)(H,34,38)/b26-18-InChIKey
GMQPSNJKBLFKCY-ITYLOYPMSA-NSynonyms
24dichloroN((1Z)3((3(morpholin4yl)propyl)amino)3oxo1(1phenyl3(thiophen2yl)1Hpyrazol4yl)prop1en2yl)benzamide
24dichloroN((Z)3(3morpholin4ylpropylamino)3oxo1(1phenyl3thiophen2ylpyrazol4yl)prop1en2yl)benzamide
C1COCCN1CCCNC(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)NC(=O)C5=C(C=C(C=C5)Cl)Cl
Clc1ccc(c(c1)Cl)C(=O)NC(=Cc1cn(nc1c1cccs1)c1ccccc1)C(=O)NCCCN1CCOCC1
InChI=1SC30H29Cl2N5O3Sc312291024(25(32)1922)29(38)3426(30(39)331151236131540161436)18212037(236213723)3528(21)2784174127h146101720H51116H2(H3339)(H3438)b2618
MFCD02972445
ZINC000097965093
ZINC97965093
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