[4-[2-azanyl-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(1-benzofuran-5-yl)methanone

Systemtic Name: [4-[2-azanyl-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(1-benzofuran-5-yl)methanone Openeye Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]-1-piperidyl]-(benzofuran-5-yl)methanone CAS Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]-4-pyrimidinyl]-1-piperidinyl]-(5-benzofuranyl)methanone IUPAC Name: [4-[2-amino-6-[(4-methoxyphenyl)methyl]pyrimidin-4-yl]piperidin-1-yl]-(1-benzofuran-5-yl)methanone Traditional Name: [4-(2-amino-6-p-anisyl-pyrimidin-4-yl)piperidino]-(benzofuran-5-yl)methanone Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NC(=NC(=C2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)OC=C5)N

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NC(=NC(=C2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)OC=C5)N

InChI

InChI=1S/C26H26N4O3/c1-32-22-5-2-17(3-6-22)14-21-16-23(29-26(27)28-21)18-8-11-30(12-9-18)25(31)20-4-7-24-19(15-20)10-13-33-24/h2-7,10,13,15-16,18H,8-9,11-12,14H2,1H3,(H2,27,28,29)