N-[4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]sulfonylphenyl]acetamide CAS Name: N-[4-[[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[4-(6-piperidinopyrimidin-4-yl)piperazino]sulfonylphenyl]acetamide Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC(=C3)N4CCCCC4

InChI

InChI=1S/C21H28N6O3S/c1-17(28)24-18-5-7-19(8-6-18)31(29,30)27-13-11-26(12-14-27)21-15-20(22-16-23-21)25-9-3-2-4-10-25/h5-8,15-16H,2-4,9-14H2,1H3,(H,24,28)