Vitas-M small molecule compound
N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2-ethylbutanamide
Catalog ID
STK211120
SMILES CCC(C(=O)/N=C(/Nc1nc(C)cc(n1)C)\NCCc1c[nH]c2c1cc(Cl)cc2)CC
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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 C23H29ClN6O MW 440.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29ClN6O/c1-5-16(6-2)21(31)29-22(30-23-27-14(3)11-15(4)28-23)25-10-9-17-13-26-20-8-7-18(24)12-19(17)20/h7-8,11-13,16,26H,5-6,9-10H2,1-4H3,(H2,25,27,28,29,30,31)InChIKey
RZRMLPVKBAVNKJ-UHFFFAOYSA-NSynonyms
(1E)1((46DIMETHYLPYRIMIDIN2YL)AMINO)1((2(5CHLOROINDOL3YL)ETHYL)AMINO)4ETHYL2AZAHEX1EN3ONE
CCC(C(=O)N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cc(Cl)cc2)CC
CCC(CC)C(=O)NC(=NCCC1=CNC2=C1C=C(C=C2)Cl)NC3=NC(=CC(=N3)C)C
InChI=1SC23H29ClN6Oc1516(62)21(31)2922(30232714(3)1115(4)2823)25109171326208718(24)1219(17)20h7811131626H56910H214H3(H2252728293031)
MFCD07157375
N((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)2ethylbutanamide
N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYL2PYRIMIDINYL)N(2ETHYLBUTANOYL)GUANIDINE
N(N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)2ETHYLBUTANAMIDE
ZINC000014671540
ZINC14671540
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