N'-tert-butyl-N-[1-[4-(4-methoxyphenyl)-5-phenyl-pyrazol-1-yl]butan-2-yl]propane-1,3-diamine

Systemtic Name: N'-tert-butyl-N-[1-[4-(4-methoxyphenyl)-5-phenyl-pyrazol-1-yl]butan-2-yl]propane-1,3-diamine Openeye Name: N'-tert-butyl-N-[1-[[4-(4-methoxyphenyl)-5-phenyl-pyrazol-1-yl]methyl]propyl]propane-1,3-diamine CAS Name: N'-tert-butyl-N-[1-[4-(4-methoxyphenyl)-5-phenyl-1-pyrazolyl]butan-2-yl]propane-1,3-diamine IUPAC Name: N'-tert-butyl-N-[1-[4-(4-methoxyphenyl)-5-phenylpyrazol-1-yl]butan-2-yl]propane-1,3-diamine Traditional Name: tert-butyl-[3-[1-[[4-(4-methoxyphenyl)-5-phenyl-pyrazol-1-yl]methyl]propylamino]propyl]amine Formula: C27H38N4O MolecularWeight: 434.61682

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1C(=C(C=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3)NCCCNC(C)(C)C

Isomeric SMILES

CCC(CN1C(=C(C=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3)NCCCNC(C)(C)C

InChI

InChI=1S/C27H38N4O/c1-6-23(28-17-10-18-29-27(2,3)4)20-31-26(22-11-8-7-9-12-22)25(19-30-31)21-13-15-24(32-5)16-14-21/h7-9,11-16,19,23,28-29H,6,10,17-18,20H2,1-5H3