5-methyl-2-phenyl-4-(4-piperidin-1-ylphenyl)imino-pyrazol-3-one

Systemtic Name: 5-methyl-2-phenyl-4-(4-piperidin-1-ylphenyl)imino-pyrazol-3-one Openeye Name: 5-methyl-2-phenyl-4-[4-(1-piperidyl)phenyl]imino-pyrazol-3-one CAS Name: 5-methyl-2-phenyl-4-[4-(1-piperidinyl)phenyl]imino-3-pyrazolone IUPAC Name: 5-methyl-2-phenyl-4-(4-piperidin-1-ylphenyl)iminopyrazol-3-one Traditional Name: 5-methyl-2-phenyl-4-(4-piperidinophenyl)imino-2-pyrazolin-3-one Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NC2=CC=C(C=C2)N3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)C1=NC2=CC=C(C=C2)N3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4O/c1-16-20(21(26)25(23-16)19-8-4-2-5-9-19)22-17-10-12-18(13-11-17)24-14-6-3-7-15-24/h2,4-5,8-13H,3,6-7,14-15H2,1H3