N-[6-chloranyl-5-(4-methylphenyl)pyrimidin-4-yl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[6-chloranyl-5-(4-methylphenyl)pyrimidin-4-yl]-4-propyl-benzenesulfonamide Openeye Name: N-[6-chloro-5-(p-tolyl)pyrimidin-4-yl]-4-propyl-benzenesulfonamide CAS Name: N-[6-chloro-5-(4-methylphenyl)-4-pyrimidinyl]-4-propylbenzenesulfonamide IUPAC Name: N-[6-chloro-5-(4-methylphenyl)pyrimidin-4-yl]-4-propylbenzenesulfonamide Traditional Name: N-[6-chloro-5-(p-tolyl)pyrimidin-4-yl]-4-propyl-benzenesulfonamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)Cl)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)Cl)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H20ClN3O2S/c1-3-4-15-7-11-17(12-8-15)27(25,26)24-20-18(19(21)22-13-23-20)16-9-5-14(2)6-10-16/h5-13H,3-4H2,1-2H3,(H,22,23,24)