5-(propan-2-ylsulfonylamino)-N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]pentanamide

Systemtic Name: 5-(propan-2-ylsulfonylamino)-N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]pentanamide Openeye Name: 5-(isopropylsulfonylamino)-N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]pentanamide CAS Name: 5-(propan-2-ylsulfonylamino)-N-[4-[4-(2-pyrimidinyl)-1-piperazinyl]phenyl]pentanamide IUPAC Name: 5-(propan-2-ylsulfonylamino)-N-[4-(4-pyrimidin-2-ylpiperazin-1-yl)phenyl]pentanamide Traditional Name: 5-(isopropylsulfonylamino)-N-[4-[4-(2-pyrimidyl)piperazino]phenyl]valeramide Formula: C22H32N6O3S MolecularWeight: 460.59288

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H32N6O3S/c1-18(2)32(30,31)25-13-4-3-6-21(29)26-19-7-9-20(10-8-19)27-14-16-28(17-15-27)22-23-11-5-12-24-22/h5,7-12,18,25H,3-4,6,13-17H2,1-2H3,(H,26,29)