Vitas-M small molecule compound
N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methoxybenzamide
Catalog ID
STK203669
SMILES COc1ccc(cc1)C(=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)17-4-7-20(34-3)8-5-17)27-11-10-18-14-28-22-9-6-19(26)13-21(18)22/h4-9,12-14,28H,10-11H2,1-3H3,(H2,27,29,30,31,32,33)InChIKey
BQIMEDQRLSKZCI-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2(5CHLOROINDOL3YL)ETHYL)AMINO)1(4METHOXYPHENYL)2AZAPROP2EN1ONE
(E)N((2(5CHLORO1HINDOL3YL)ETHYLAMINO)(46DIMETHYLPYRIMIDIN2YLAMINO)METHYLENE)4METHOXYBENZAMIDE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C4=CC=C(C=C4)OC)C
COc1ccc(cc1)C(=O)N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cc(Cl)cc2
InChI=1SC25H25ClN6O2c1151216(2)3025(2915)3224(3123(33)174720(343)8517)271110181428229619(26)1321(18)22h49121428H1011H213H3(H2272930313233)
MFCD06650262
N((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)4methoxybenzamide
N(N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)4METHOXYBENZAMIDE
ZINC000014671529
ZINC14671529
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