5-[(3-chlorophenyl)methyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 5-[(3-chlorophenyl)methyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 5-[(3-chlorophenyl)methyl]-2-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methyl-1H-pyrimidin-4-one CAS Name: 5-[(3-chlorophenyl)methyl]-2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 5-[(3-chlorophenyl)methyl]-2-[4-(furan-2-carbonyl)piperazin-1-yl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 5-(3-chlorobenzyl)-2-[4-(2-furoyl)piperazino]-6-methyl-1H-pyrimidin-4-one Formula: C21H21ClN4O3 MolecularWeight: 412.86944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C(=O)C3=CC=CO3)CC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=O)N=C(N1)N2CCN(CC2)C(=O)C3=CC=CO3)CC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H21ClN4O3/c1-14-17(13-15-4-2-5-16(22)12-15)19(27)24-21(23-14)26-9-7-25(8-10-26)20(28)18-6-3-11-29-18/h2-6,11-12H,7-10,13H2,1H3,(H,23,24,27)