N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxidanylidene-butyl]benzamide

Systemtic Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxidanylidene-butyl]benzamide Openeye Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxo-butyl]benzamide CAS Name: N-[4-[(1,3-diphenyl-4-pyrazolyl)methylamino]-4-oxobutyl]benzamide IUPAC Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-oxobutyl]benzamide Traditional Name: N-[4-[(1,3-diphenylpyrazol-4-yl)methylamino]-4-keto-butyl]benzamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CCCNC(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2CNC(=O)CCCNC(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H26N4O2/c32-25(17-10-18-28-27(33)22-13-6-2-7-14-22)29-19-23-20-31(24-15-8-3-9-16-24)30-26(23)21-11-4-1-5-12-21/h1-9,11-16,20H,10,17-19H2,(H,28,33)(H,29,32)