Vitas-M small molecule compound
3-(4-chlorophenyl)-N-{(E)-[2-(heptyloxy)phenyl]methylidene}-1-phenyl-1H-pyrazol-5-amine
Catalog ID
STK003776
SMILES CCCCCCCOc1ccccc1/C=N/c1cc(nn1c1ccccc1)c1ccc(cc1)Cl
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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 C29H30ClN3O MW 472.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30ClN3O/c1-2-3-4-5-11-20-34-28-15-10-9-12-24(28)22-31-29-21-27(23-16-18-25(30)19-17-23)32-33(29)26-13-7-6-8-14-26/h6-10,12-19,21-22H,2-5,11,20H2,1H3/b31-22+InChIKey
RYJBGLPEGDRZTD-DFKUXCBWSA-NSynonyms
(E)N(5(4chlorophenyl)2phenylpyrazol3yl)1(2heptoxyphenyl)methanimine
3(4CHLOROPHENYL)N((E)(2(HEPTYLOXY)PHENYL)METHYLIDENE)1PHENYL1HPYRAZOL5AMINE
CCCCCCCOC1=CC=CC=C1C=NC2=CC(=NN2C3=CC=CC=C3)C4=CC=C(C=C4)Cl
CCCCCCCOc1ccccc1C=Nc1cc(nn1c1ccccc1)c1ccc(cc1)Cl
InChI=1SC29H30ClN3Oc1234511203428151091224(28)2231292127(23161825(30)191723)3233(29)26137681426h61012192122H251120H21H3b3122+
MFCD01964075
STK003776
ZINC000097957767
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