N-(2,2-dimethyl-3H-1-benzofuran-5-yl)-4-phenyl-5-(4-prop-2-ynoxyphenyl)-3,4-dihydropyrazole-2-carboxamide

Systemtic Name: N-(2,2-dimethyl-3H-1-benzofuran-5-yl)-4-phenyl-5-(4-prop-2-ynoxyphenyl)-3,4-dihydropyrazole-2-carboxamide Openeye Name: N-(2,2-dimethyl-3H-benzofuran-5-yl)-4-phenyl-5-(4-prop-2-ynoxyphenyl)-3,4-dihydropyrazole-2-carboxamide CAS Name: N-(2,2-dimethyl-3H-benzofuran-5-yl)-4-phenyl-5-(4-prop-2-ynoxyphenyl)-3,4-dihydropyrazole-2-carboxamide IUPAC Name: N-(2,2-dimethyl-3H-1-benzofuran-5-yl)-4-phenyl-5-(4-prop-2-ynoxyphenyl)-3,4-dihydropyrazole-2-carboxamide Traditional Name: N-(2,2-dimethylcoumaran-5-yl)-4-phenyl-3-(4-propargyloxyphenyl)-2-pyrazoline-1-carboxamide Formula: C29H27N3O3 MolecularWeight: 465.54298

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C=CC(=C2)NC(=O)N3CC(C(=N3)C4=CC=C(C=C4)OCC#C)C5=CC=CC=C5)C

Isomeric SMILES

CC1(CC2=C(O1)C=CC(=C2)NC(=O)N3CC(C(=N3)C4=CC=C(C=C4)OCC#C)C5=CC=CC=C5)C

InChI

InChI=1S/C29H27N3O3/c1-4-16-34-24-13-10-21(11-14-24)27-25(20-8-6-5-7-9-20)19-32(31-27)28(33)30-23-12-15-26-22(17-23)18-29(2,3)35-26/h1,5-15,17,25H,16,18-19H2,2-3H3,(H,30,33)