2-(4-chlorophenyl)-1-[4-[4-(furan-2-yl)pyrimidin-2-yl]piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: 2-(4-chlorophenyl)-1-[4-[4-(furan-2-yl)pyrimidin-2-yl]piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: 2-(4-chlorophenyl)-1-[4-[4-(2-furyl)pyrimidin-2-yl]piperazin-1-yl]-3-methyl-butan-1-one CAS Name: 2-(4-chlorophenyl)-1-[4-[4-(2-furanyl)-2-pyrimidinyl]-1-piperazinyl]-3-methyl-1-butanone IUPAC Name: 2-(4-chlorophenyl)-1-[4-[4-(furan-2-yl)pyrimidin-2-yl]piperazin-1-yl]-3-methylbutan-1-one Traditional Name: 2-(4-chlorophenyl)-1-[4-[4-(2-furyl)pyrimidin-2-yl]piperazino]-3-methyl-butan-1-one Formula: C23H25ClN4O2 MolecularWeight: 424.9232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=NC=CC(=N3)C4=CC=CO4

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=NC=CC(=N3)C4=CC=CO4

InChI

InChI=1S/C23H25ClN4O2/c1-16(2)21(17-5-7-18(24)8-6-17)22(29)27-11-13-28(14-12-27)23-25-10-9-19(26-23)20-4-3-15-30-20/h3-10,15-16,21H,11-14H2,1-2H3