Vitas-M small molecule compound
4-chloro-N-{(1Z)-3-(2,6-dimethylmorpholin-4-yl)-3-oxo-1-[1-phenyl-3-(thiophen-2-yl)-1H-pyrazol-4-yl]prop-1-en-2-yl}benzamide
Catalog ID
STK873213
SMILES CC1OC(C)CN(C1)C(=O)/C(=C/c1cn(nc1c1cccs1)c1ccccc1)/NC(=O)c1ccc(cc1)Cl
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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 C29H27ClN4O3S MW 547.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN4O3S/c1-19-16-33(17-20(2)37-19)29(36)25(31-28(35)21-10-12-23(30)13-11-21)15-22-18-34(24-7-4-3-5-8-24)32-27(22)26-9-6-14-38-26/h3-15,18-20H,16-17H2,1-2H3,(H,31,35)/b25-15-InChIKey
IQPQSOMTYQYZPB-MYYYXRDXSA-NSynonyms
4chloroN((1Z)3(26dimethylmorpholin4yl)3oxo1(1phenyl3(thiophen2yl)1Hpyrazol4yl)prop1en2yl)benzamide
4CHLORON((Z)3(26DIMETHYLMORPHOLIN4YL)3OXO1(1PHENYL3THIOPHEN2YLPYRAZOL4YL)PROP1EN2YL)BENZAMIDE
CC1CN(CC(O1)C)C(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)NC(=O)C5=CC=C(C=C5)Cl
CC1OC(C)CN(C1)C(=O)C(=Cc1cn(nc1c1cccs1)c1ccccc1)NC(=O)c1ccc(cc1)Cl
InChI=1SC29H27ClN4O3Sc1191633(1720(2)3719)29(36)25(3128(35)21101223(30)131121)15221834(247435824)3227(22)2696143826h3151820H1617H212H3(H3135)b2515
MFCD02972494
ZINC000000953950
ZINC000100766908
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