Vitas-M small molecule compound
N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2-(methylamino)benzamide
Catalog ID
STK211129
SMILES CNc1ccccc1C(=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 C25H26ClN7O MW 475.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN7O/c1-15-12-16(2)31-25(30-15)33-24(32-23(34)19-6-4-5-7-21(19)27-3)28-11-10-17-14-29-22-9-8-18(26)13-20(17)22/h4-9,12-14,27,29H,10-11H2,1-3H3,(H2,28,30,31,32,33,34)InChIKey
HWZXSXAWKROZRH-UHFFFAOYSA-NSynonyms
(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2(5CHLOROINDOL3YL)ETHYL)AMINO)1(2(METHYLAMINO)PHENYL)2AZAPROP2EN1ONE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C4=CC=CC=C4NC)C
CNc1ccccc1C(=O)N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cc(Cl)cc2
InChI=1SC25H26ClN7Oc1151216(2)3125(3015)3324(3223(34)19645721(19)273)281110171429229818(26)1320(17)22h4912142729H1011H213H3(H2283031323334)
MFCD07157384
N((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)2(methylamino)benzamide
N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYL2PYRIMIDINYL)N(2METHYLAMINOBENZOYL)GUANIDINE
N(N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)2(METHYLAMINO)BENZAMIDE
ZINC000014671546
ZINC14671546
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