4-chloranyl-N-[(1S)-3-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(1S)-3-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide Openeye Name: 4-chloro-N-[(1S)-3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide CAS Name: 4-chloro-N-[(1S)-3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]-1-phenylpropyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(1S)-3-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]-1-phenylpropyl]benzenesulfonamide Traditional Name: 4-chloro-N-[(1S)-3-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]-1-phenyl-propyl]benzenesulfonamide Formula: C22H24ClN3O3S2 MolecularWeight: 478.02726

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCCC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC[C@@H](C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3O3S2/c1-2-6-18-15-21(27)25-22(24-18)30-14-13-20(16-7-4-3-5-8-16)26-31(28,29)19-11-9-17(23)10-12-19/h3-5,7-12,15,20,26H,2,6,13-14H2,1H3,(H,24,25,27)/t20-/m0/s1