Vitas-M small molecule compound
N-[2-(4-fluorophenyl)-2-(1H-indol-3-yl)ethyl]-N~3~-pyrimidin-2-yl-beta-alaninamide
Catalog ID
STL317517
SMILES O=C(NCC(c1c[nH]c2c1cccc2)c1ccc(cc1)F)CCNc1ncccn1
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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 C23H22FN5O MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN5O/c24-17-8-6-16(7-9-17)19(20-15-28-21-5-2-1-4-18(20)21)14-29-22(30)10-13-27-23-25-11-3-12-26-23/h1-9,11-12,15,19,28H,10,13-14H2,(H,29,30)(H,25,26,27)InChIKey
RRDRUFXLWPDXSN-UHFFFAOYSA-NSynonyms
1401568-10-21401568102
C1=CC=C2C(=C1)C(=CN2)C(CNC(=O)CCNC3=NC=CC=N3)C4=CC=C(C=C4)F
InChI=1SC23H22FN5Oc24178616(7917)19(20152821521418(20)21)142922(30)1013272325113122623h191112151928H101314H2(H2930)(H252627)
MFCD22584551
N(2(4fluorophenyl)2(1Hindol3yl)ethyl)3(pyrimidin2ylamino)propanamide
N(2(4fluorophenyl)2(1Hindol3yl)ethyl)N~3~pyrimidin2ylbetaalaninamide
N(2(4FLUOROPHENYL)2(1HINDOL3YL)ETHYL)N3PYRIMIDIN2YLBETAALANINAMIDE
O=C(NCC(c1c(nH)c2c1cccc2)c1ccc(cc1)F)CCNc1ncccn1
ZINC000079488105
ZINC000079488108
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