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

Systemtic Name: (4-butoxyphenyl)-[4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-(4-methyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-[4-methyl-6-(1-pyrrolidinyl)-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-(4-methyl-6-pyrrolidin-1-ylpyrimidin-2-yl)piperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-(4-methyl-6-pyrrolidino-pyrimidin-2-yl)piperazino]methanone Formula: C24H33N5O2 MolecularWeight: 423.55112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=CC(=N3)N4CCCC4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=CC(=N3)N4CCCC4)C

InChI

InChI=1S/C24H33N5O2/c1-3-4-17-31-21-9-7-20(8-10-21)23(30)28-13-15-29(16-14-28)24-25-19(2)18-22(26-24)27-11-5-6-12-27/h7-10,18H,3-6,11-17H2,1-2H3