N-[4-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]propanamide

Systemtic Name: N-[4-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]propanamide Openeye Name: N-[4-[4-(6-morpholinopyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]propanamide CAS Name: N-[4-[[4-[6-(4-morpholinyl)-4-pyrimidinyl]-1-piperazinyl]sulfonyl]phenyl]propanamide IUPAC Name: N-[4-[4-(6-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]propanamide Traditional Name: N-[4-[4-(6-morpholinopyrimidin-4-yl)piperazino]sulfonylphenyl]propionamide Formula: C21H28N6O4S MolecularWeight: 460.54982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=NC=N3)N4CCOCC4

InChI

InChI=1S/C21H28N6O4S/c1-2-21(28)24-17-3-5-18(6-4-17)32(29,30)27-9-7-25(8-10-27)19-15-20(23-16-22-19)26-11-13-31-14-12-26/h3-6,15-16H,2,7-14H2,1H3,(H,24,28)