[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-[3-(phenoxymethyl)-1-benzofuran-2-yl]methanone

Systemtic Name: [4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-[3-(phenoxymethyl)-1-benzofuran-2-yl]methanone Openeye Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-[3-(phenoxymethyl)benzofuran-2-yl]methanone CAS Name: [4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-[3-(phenoxymethyl)-2-benzofuranyl]methanone IUPAC Name: [4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-[3-(phenoxymethyl)-1-benzofuran-2-yl]methanone Traditional Name: [4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-[3-(phenoxymethyl)benzofuran-2-yl]methanone Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5

InChI

InChI=1S/C28H30N4O3/c1-19(2)27-29-20(3)17-25(30-27)31-13-15-32(16-14-31)28(33)26-23(18-34-21-9-5-4-6-10-21)22-11-7-8-12-24(22)35-26/h4-12,17,19H,13-16,18H2,1-3H3