Vitas-M small molecule compound

1-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-ethylurea

Catalog ID
STK211139
SMILES CCNC(=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 C20H24ClN7O MW 413.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24ClN7O/c1-4-22-20(29)28-18(27-19-25-12(2)9-13(3)26-19)23-8-7-14-11-24-17-6-5-15(21)10-16(14)17/h5-6,9-11,24H,4,7-8H2,1-3H3,(H3,22,23,25,26,27,28,29)
InChIKey
BGPLAFZFRCMFQZ-UHFFFAOYSA-N
Synonyms

(2E)3((46DIMETHYLPYRIMIDIN2YL)AMINO)3((2(5CHLOROINDOL3YL)ETHYL)AMINO)NETHYL2AZAPROP2ENAMIDE
1((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)3ethylurea
1(N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)3ETHYLUREA
CCNC(=O)N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cc(Cl)cc2
CCNC(=O)NC(=NCCC1=CNC2=C1C=C(C=C2)Cl)NC3=NC(=CC(=N3)C)C
InChI=1SC20H24ClN7Oc142220(29)2818(27192512(2)913(3)2619)2387141124176515(21)1016(14)17h5691124H478H213H3(H322232526272829)
MFCD07157394
N((E)((2(5CHLORO1HINDOL3YL)ETHYL)AMINO)((46DIMETHYL2PYRIMIDINYL)AMINO)METHYLIDENE)NETHYLUREA
ZINC000018192674
ZINC18192674

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Available files

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