3-(3-methoxyphenyl)-1-(4-methylphenyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]pyrazole-4-carboxamide

Systemtic Name: 3-(3-methoxyphenyl)-1-(4-methylphenyl)-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]pyrazole-4-carboxamide Openeye Name: 3-(3-methoxyphenyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]-1-(p-tolyl)pyrazole-4-carboxamide CAS Name: 3-(3-methoxyphenyl)-1-(4-methylphenyl)-N-[4-(3-oxo-1-piperazinyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 3-(3-methoxyphenyl)-1-(4-methylphenyl)-N-[4-(3-oxopiperazin-1-yl)phenyl]pyrazole-4-carboxamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-3-(3-methoxyphenyl)-1-(p-tolyl)pyrazole-4-carboxamide Formula: C28H27N5O3 MolecularWeight: 481.54568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OC)C(=O)NC4=CC=C(C=C4)N5CCNC(=O)C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OC)C(=O)NC4=CC=C(C=C4)N5CCNC(=O)C5

InChI

InChI=1S/C28H27N5O3/c1-19-6-10-23(11-7-19)33-17-25(27(31-33)20-4-3-5-24(16-20)36-2)28(35)30-21-8-12-22(13-9-21)32-15-14-29-26(34)18-32/h3-13,16-17H,14-15,18H2,1-2H3,(H,29,34)(H,30,35)