2-(4-ethoxyphenoxy)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(4-ethoxyphenoxy)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-(4-ethoxyphenoxy)-1-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 2-(4-ethoxyphenoxy)-1-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(4-ethoxyphenoxy)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-(4-ethoxyphenoxy)-1-[4-(6-piperidinopyrimidin-4-yl)piperazino]propan-1-one Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

InChI

InChI=1S/C24H33N5O3/c1-3-31-20-7-9-21(10-8-20)32-19(2)24(30)29-15-13-28(14-16-29)23-17-22(25-18-26-23)27-11-5-4-6-12-27/h7-10,17-19H,3-6,11-16H2,1-2H3