N-(2-cyanoethyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide

Systemtic Name: N-(2-cyanoethyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide Openeye Name: N-(2-cyanoethyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide CAS Name: N-(2-cyanoethyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide IUPAC Name: N-(2-cyanoethyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide Traditional Name: N-(2-cyanoethyl)-4-[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]benzamide Formula: C20H18N4O2 MolecularWeight: 346.38252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C3=CC=C(C=C3)C(=O)NCCC#N

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C3=CC=C(C=C3)C(=O)NCCC#N

InChI

InChI=1S/C20H18N4O2/c1-26-17-5-2-4-16(12-17)19-13-18(23-24-19)14-6-8-15(9-7-14)20(25)22-11-3-10-21/h2,4-9,12-13H,3,11H2,1H3,(H,22,25)(H,23,24)