N-[4-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylphenyl]ethanamide

Systemtic Name: N-[4-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylphenyl]ethanamide Openeye Name: N-[4-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylphenyl]acetamide CAS Name: N-[4-[[4-[5-(4-chlorophenyl)-2-pyrimidinyl]-1-piperazinyl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazin-1-yl]sulfonylphenyl]acetamide Traditional Name: N-[4-[4-[5-(4-chlorophenyl)pyrimidin-2-yl]piperazino]sulfonylphenyl]acetamide Formula: C22H22ClN5O3S MolecularWeight: 471.95978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=C(C=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN5O3S/c1-16(29)26-20-6-8-21(9-7-20)32(30,31)28-12-10-27(11-13-28)22-24-14-18(15-25-22)17-2-4-19(23)5-3-17/h2-9,14-15H,10-13H2,1H3,(H,26,29)