4-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-6-piperidin-1-yl-pyrimidine

Systemtic Name: 4-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-6-piperidin-1-yl-pyrimidine Openeye Name: 4-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-6-(1-piperidyl)pyrimidine CAS Name: 4-[4-(2,4-diethoxyphenyl)sulfonyl-1-piperazinyl]-6-(1-piperidinyl)pyrimidine IUPAC Name: 4-[4-(2,4-diethoxyphenyl)sulfonylpiperazin-1-yl]-6-piperidin-1-ylpyrimidine Traditional Name: 4-[4-(2,4-diethoxyphenyl)sulfonylpiperazino]-6-piperidino-pyrimidine Formula: C23H33N5O4S MolecularWeight: 475.60422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H33N5O4S/c1-3-31-19-8-9-21(20(16-19)32-4-2)33(29,30)28-14-12-27(13-15-28)23-17-22(24-18-25-23)26-10-6-5-7-11-26/h8-9,16-18H,3-7,10-15H2,1-2H3