Vitas-M small molecule compound
N-[(Z)-[(4,6-dimethylpyrimidin-2-yl)amino]{[2-(6-methoxy-1H-indol-3-yl)ethyl]amino}methylidene]-2-[4-(diphenylmethyl)piperazin-1-yl]acetamide
Catalog ID
STL448010
SMILES COc1ccc2c(c1)[nH]cc2CCN/C(=N/C(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)/Nc1nc(C)cc(n1)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 C37H42N8O2 MW 630.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H42N8O2/c1-26-22-27(2)41-37(40-26)43-36(38-17-16-30-24-39-33-23-31(47-3)14-15-32(30)33)42-34(46)25-44-18-20-45(21-19-44)35(28-10-6-4-7-11-28)29-12-8-5-9-13-29/h4-15,22-24,35,39H,16-21,25H2,1-3H3,(H2,38,40,41,42,43,46)InChIKey
LXJOJOLDNPRJMV-UHFFFAOYSA-NSynonyms
(E)2(4BENZHYDRYLPIPERAZIN1YL)N((46DIMETHYLPYRIMIDIN2YLAMINO)(2(6METHOXY1HINDOL3YL)ETHYLAMINO)METHYLENE)ACETAMIDE
2(4BENZHYDRYLPIPERAZIN1YL)N(N(46DIMETHYLPYRIMIDIN2YL)N(2(6METHOXY1HINDOL3YL)ETHYL)CARBAMIMIDOYL)ACETAMIDE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=CC(=C3)OC)NC(=O)CN4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6)C
COc1ccc2c(c1)(nH)cc2CCNC(=NC(=O)CN1CCN(CC1)C(c1ccccc1)c1ccccc1)Nc1nc(C)cc(n1)C
InChI=1SC37H42N8O2c1262227(2)4137(4026)4336(381716302439332331(473)141532(30)33)4234(46)2544182045(211944)35(28106471128)29128591329h41522243539H162125H213H3(H2384041424346)
MFCD30712962
N((Z)((46dimethylpyrimidin2yl)amino)((2(6methoxy1Hindol3yl)ethyl)amino)methylidene)2(4(diphenylmethyl)piperazin1yl)acetamide
ZINC000101381741
ZINC101381741
Check stock
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Check stock on Vitas-MAvailable files
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