Vitas-M small molecule compound

1-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(1H-indol-3-yl)ethyl]amino}methylidene]-3-(3,4,5-trimethoxyphenyl)urea

Catalog ID
STK203713
SMILES COc1cc(NC(=O)/N=C(\Nc2nc(C)cc(n2)C)/NCCc2c[nH]c3c2cccc3)cc(c1OC)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 C27H31N7O4 MW 517.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N7O4/c1-16-12-17(2)31-26(30-16)33-25(28-11-10-18-15-29-21-9-7-6-8-20(18)21)34-27(35)32-19-13-22(36-3)24(38-5)23(14-19)37-4/h6-9,12-15,29H,10-11H2,1-5H3,(H3,28,30,31,32,33,34,35)
InChIKey
HIAIMJLPKGRICP-UHFFFAOYSA-N
Synonyms
827009-50-7
(2Z)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2INDOL3YLETHYL)AMINO)N(345TRIMETHOXYPHENYL)2AZAPROP2ENAMIDE
(Z)1(((2(1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylene)3(345trimethoxyphenyl)urea
(Z)1((2(1HINDOL3YL)ETHYLAMINO)(46DIMETHYLPYRIMIDIN2YLAMINO)METHYLENE)3(345TRIMETHOXYPHENYL)UREA
1((Z)((46dimethylpyrimidin2yl)amino)((2(1Hindol3yl)ethyl)amino)methylidene)3(345trimethoxyphenyl)urea
1(N(46DIMETHYLPYRIMIDIN2YL)N(2(1HINDOL3YL)ETHYL)CARBAMIMIDOYL)3(345TRIMETHOXYPHENYL)UREA
827009507
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=CC=CC=C32)NC(=O)NC4=CC(=C(C(=C4)OC)OC)OC)C
COc1cc(NC(=O)N=C(Nc2nc(C)cc(n2)C)NCCc2c(nH)c3c2cccc3)cc(c1OC)OC
InChI=1SC27H31N7O4c1161217(2)3126(3016)3325(28111018152921976820(18)21)3427(35)32191322(363)24(385)23(1419)374h69121529H1011H215H3(H328303132333435)
MFCD06650301
ZINC000008771107
ZINC08771107
ZINC8771107

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Available files

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