N-[3-(4-chloranyl-6-methyl-pyrimidin-5-yl)propyl]-4-methyl-N-phenyl-benzenesulfonamide

Systemtic Name: N-[3-(4-chloranyl-6-methyl-pyrimidin-5-yl)propyl]-4-methyl-N-phenyl-benzenesulfonamide Openeye Name: N-[3-(4-chloro-6-methyl-pyrimidin-5-yl)propyl]-4-methyl-N-phenyl-benzenesulfonamide CAS Name: N-[3-(4-chloro-6-methyl-5-pyrimidinyl)propyl]-4-methyl-N-phenylbenzenesulfonamide IUPAC Name: N-[3-(4-chloro-6-methylpyrimidin-5-yl)propyl]-4-methyl-N-phenylbenzenesulfonamide Traditional Name: N-[3-(4-chloro-6-methyl-pyrimidin-5-yl)propyl]-4-methyl-N-phenyl-benzenesulfonamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(N=CN=C2Cl)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCCC2=C(N=CN=C2Cl)C)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClN3O2S/c1-16-10-12-19(13-11-16)28(26,27)25(18-7-4-3-5-8-18)14-6-9-20-17(2)23-15-24-21(20)22/h3-5,7-8,10-13,15H,6,9,14H2,1-2H3