(4-butoxyphenyl)-[4-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[4-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-[4-(dimethylamino)-6-methyl-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-[4-(dimethylamino)-6-methylpyrimidin-2-yl]piperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-[4-(dimethylamino)-6-methyl-pyrimidin-2-yl]piperazino]methanone Formula: C22H31N5O2 MolecularWeight: 397.51384

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=CC(=N3)N(C)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=CC(=N3)N(C)C)C

InChI

InChI=1S/C22H31N5O2/c1-5-6-15-29-19-9-7-18(8-10-19)21(28)26-11-13-27(14-12-26)22-23-17(2)16-20(24-22)25(3)4/h7-10,16H,5-6,11-15H2,1-4H3