Chemical Component Summary

Name1-[5-tert-butyl-2-(4-methylphenyl)-1,2-dihydro-3H-pyrazol-3-ylidene]-3-{3-[(pyridin-3-yloxy)methyl]-1H-pyrazol-5-yl}urea
Identifiers1-[5-tert-butyl-2-(4-methylphenyl)-1H-pyrazol-3-ylidene]-3-[5-(pyridin-3-yloxymethyl)-2H-pyrazol-3-yl]urea
FormulaC24 H27 N7 O2
Molecular Weight445.517
TypeNON-POLYMER
Isomeric SMILESCc1ccc(cc1)N2C(=NC(=O)Nc3cc(n[nH]3)COc4cccnc4)C=C(N2)C(C)(C)C
InChIInChI=1S/C24H27N7O2/c1-16-7-9-18(10-8-16)31-22(13-20(30-31)24(2,3)4)27-23(32)26-21-12-17(28-29-21)15-33-19-6-5-11-25-14-19/h5-14,30H,15H2,1-4H3,(H2,26,28,29,32)/b27-22+
InChIKeyOGYYVRWSDKOCHJ-HPNDGRJYSA-N

Chemical Details

Formal Charge0
Atom Count60
Chiral Atom Count0
Bond Count63
Aromatic Bond Count17