2-[[4-(N'-propan-2-ylcarbamimidoyl)-1-benzofuran-2-yl]methyl]-1-benzofuran-4-carboximidamide

Systemtic Name: 2-[[4-(N'-propan-2-ylcarbamimidoyl)-1-benzofuran-2-yl]methyl]-1-benzofuran-4-carboximidamide Openeye Name: 2-[[4-(N'-isopropylcarbamimidoyl)benzofuran-2-yl]methyl]benzofuran-4-carboxamidine CAS Name: 2-[[4-[amino(propan-2-ylimino)methyl]-2-benzofuranyl]methyl]-4-benzofurancarboximidamide IUPAC Name: 2-[[4-(N'-propan-2-ylcarbamimidoyl)-1-benzofuran-2-yl]methyl]-1-benzofuran-4-carboximidamide Traditional Name: 2-[[4-(N'-isopropylamidino)benzofuran-2-yl]methyl]benzofuran-4-carboxamidine Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N=C(C1=C2C=C(OC2=CC=C1)CC3=CC4=C(C=CC=C4O3)C(=N)N)N

Isomeric SMILES

CC(C)N=C(C1=C2C=C(OC2=CC=C1)CC3=CC4=C(C=CC=C4O3)C(=N)N)N

InChI

InChI=1S/C22H22N4O2/c1-12(2)26-22(25)16-6-4-8-20-18(16)11-14(28-20)9-13-10-17-15(21(23)24)5-3-7-19(17)27-13/h3-8,10-12H,9H2,1-2H3,(H3,23,24)(H2,25,26)