(3,4-diethoxyphenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (3,4-diethoxyphenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (3,4-diethoxyphenyl)-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (3,4-diethoxyphenyl)-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (3,4-diethoxyphenyl)-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (3,4-diethoxyphenyl)-[4-(6-piperidinopyrimidin-4-yl)piperazino]methanone Formula: C24H33N5O3 MolecularWeight: 439.55052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33N5O3/c1-3-31-20-9-8-19(16-21(20)32-4-2)24(30)29-14-12-28(13-15-29)23-17-22(25-18-26-23)27-10-6-5-7-11-27/h8-9,16-18H,3-7,10-15H2,1-2H3