N-[(E)-(4-butoxyphenyl)methylideneamino]-3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(4-butoxyphenyl)methyleneamino]-3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(4-butoxyphenyl)methylideneamino]-3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-(4-butoxybenzylidene)amino]-3-p-phenetyl-1H-pyrazole-5-carboxamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=NNC(=O)C2=CC(=NN2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C23H26N4O3/c1-3-5-14-30-20-10-6-17(7-11-20)16-24-27-23(28)22-15-21(25-26-22)18-8-12-19(13-9-18)29-4-2/h6-13,15-16H,3-5,14H2,1-2H3,(H,25,26)(H,27,28)/b24-16+