Vitas-M small molecule compound
N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2-methoxybenzamide
Catalog ID
STK211128
SMILES COc1ccccc1C(=O)/N=C(/Nc1nc(C)cc(n1)C)\NCCc1c[nH]c2c1cc(Cl)cc2
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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 C25H25ClN6O2 MW 476.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN6O2/c1-15-12-16(2)30-25(29-15)32-24(31-23(33)19-6-4-5-7-22(19)34-3)27-11-10-17-14-28-21-9-8-18(26)13-20(17)21/h4-9,12-14,28H,10-11H2,1-3H3,(H2,27,29,30,31,32,33)InChIKey
CQMIPGOJFGGFNF-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2(5CHLOROINDOL3YL)ETHYL)AMINO)1(2METHOXYPHENYL)2AZAPROP2EN1ONE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C4=CC=CC=C4OC)C
COc1ccccc1C(=O)N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cc(Cl)cc2
InChI=1SC25H25ClN6O2c1151216(2)3025(2915)3224(3123(33)19645722(19)343)271110171428219818(26)1320(17)21h49121428H1011H213H3(H2272930313233)
MFCD07157383
N((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)2methoxybenzamide
N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYL2PYRIMIDINYL)N(2METHOXYBENZOYL)GUANIDINE
N(N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)2METHOXYBENZAMIDE
ZINC000008758657
ZINC8758657
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