3-(1-benzofuran-2-yl)-1-(2-cyanoethyl)-N-(4-methoxyphenyl)pyrazole-4-carboxamide

Systemtic Name: 3-(1-benzofuran-2-yl)-1-(2-cyanoethyl)-N-(4-methoxyphenyl)pyrazole-4-carboxamide Openeye Name: 3-(benzofuran-2-yl)-1-(2-cyanoethyl)-N-(4-methoxyphenyl)pyrazole-4-carboxamide CAS Name: 3-(2-benzofuranyl)-1-(2-cyanoethyl)-N-(4-methoxyphenyl)-4-pyrazolecarboxamide IUPAC Name: 3-(1-benzofuran-2-yl)-1-(2-cyanoethyl)-N-(4-methoxyphenyl)pyrazole-4-carboxamide Traditional Name: 3-(benzofuran-2-yl)-1-(2-cyanoethyl)-N-(4-methoxyphenyl)pyrazole-4-carboxamide Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC4=CC=CC=C4O3)CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CN(N=C2C3=CC4=CC=CC=C4O3)CCC#N

InChI

InChI=1S/C22H18N4O3/c1-28-17-9-7-16(8-10-17)24-22(27)18-14-26(12-4-11-23)25-21(18)20-13-15-5-2-3-6-19(15)29-20/h2-3,5-10,13-14H,4,12H2,1H3,(H,24,27)