2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-cyanophenyl)methyl]-2-ethoxy-ethanamide

Systemtic Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-cyanophenyl)methyl]-2-ethoxy-ethanamide Openeye Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-cyanophenyl)methyl]-2-ethoxy-acetamide CAS Name: 2-[3-(3-aminophenyl)-1-pyrazolyl]-N-[(4-cyanophenyl)methyl]-2-ethoxyacetamide IUPAC Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-[(4-cyanophenyl)methyl]-2-ethoxyacetamide Traditional Name: 2-[3-(3-aminophenyl)pyrazol-1-yl]-N-(4-cyanobenzyl)-2-ethoxy-acetamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=CC=C(C=C1)C#N)N2C=CC(=N2)C3=CC(=CC=C3)N

Isomeric SMILES

CCOC(C(=O)NCC1=CC=C(C=C1)C#N)N2C=CC(=N2)C3=CC(=CC=C3)N

InChI

InChI=1S/C21H21N5O2/c1-2-28-21(20(27)24-14-16-8-6-15(13-22)7-9-16)26-11-10-19(25-26)17-4-3-5-18(23)12-17/h3-12,21H,2,14,23H2,1H3,(H,24,27)