Vitas-M small molecule compound
5-(2-chlorophenyl)-3-{[2-(1H-imidazol-5-yl)ethyl]amino}cyclohex-2-en-1-one
Catalog ID
STK207337
SMILES O=C1C=C(NCCc2cnc[nH]2)CC(C1)c1ccccc1Cl
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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 C17H18ClN3O MW 315.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O/c18-17-4-2-1-3-16(17)12-7-14(9-15(22)8-12)20-6-5-13-10-19-11-21-13/h1-4,9-12,20H,5-8H2,(H,19,21)InChIKey
ZAGAVSCPMWXEAJ-UHFFFAOYSA-NSynonyms
5(2CHLOROPHENYL)3((2(1HIMIDAZOL4YL)ETHYL)AMINO)CYCLOHEX2EN1ONE
5(2chlorophenyl)3((2(1Himidazol5yl)ethyl)amino)cyclohex2en1one
5(2CHLOROPHENYL)3(2(1HIMIDAZOL5YL)ETHYLAMINO)CYCLOHEX2EN1ONE
C1C(CC(=O)C=C1NCCC2=CN=CN2)C3=CC=CC=C3Cl
InChI=1SC17H18ClN3Oc1817421316(17)12714(915(22)812)2065131019112113h1491220H58H2(H1921)
MFCD06754511
O=C1C=C(NCCc2cnc(nH)2)CC(C1)c1ccccc1Cl
ZINC000100233677
ZINC000100233679
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