3-chloranyl-N-[(2S)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[(2S)-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]benzenesulfonamide Openeye Name: 3-chloro-N-[(1S)-1-methyl-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]benzenesulfonamide CAS Name: 3-chloro-N-[(2S)-1-oxo-1-[4-(2-pyrimidinyl)-1-piperazinyl]propan-2-yl]benzenesulfonamide IUPAC Name: 3-chloro-N-[(2S)-1-oxo-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-yl]benzenesulfonamide Traditional Name: 3-chloro-N-[(1S)-2-keto-1-methyl-2-[4-(2-pyrimidyl)piperazino]ethyl]benzenesulfonamide Formula: C17H20ClN5O3S MolecularWeight: 409.8904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=CC=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C[C@@H](C(=O)N1CCN(CC1)C2=NC=CC=N2)NS(=O)(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H20ClN5O3S/c1-13(21-27(25,26)15-5-2-4-14(18)12-15)16(24)22-8-10-23(11-9-22)17-19-6-3-7-20-17/h2-7,12-13,21H,8-11H2,1H3/t13-/m0/s1