1-(4,6-dimethylpyrimidin-2-yl)-3-(4-methylphenyl)-2-(phenylsulfonyl)guanidine

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-methylphenyl)-2-(phenylsulfonyl)guanidine Openeye Name: 2-(benzenesulfonyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-(p-tolyl)guanidine CAS Name: 2-(benzenesulfonyl)-1-(4,6-dimethyl-2-pyrimidinyl)-3-(4-methylphenyl)guanidine IUPAC Name: 2-(benzenesulfonyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-(4-methylphenyl)guanidine Traditional Name: 2-besyl-1-(4,6-dimethylpyrimidin-2-yl)-3-(p-tolyl)guanidine Formula: C20H21N5O2S MolecularWeight: 395.47804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=CC=C2)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N/C(=N\S(=O)(=O)C2=CC=CC=C2)/NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C20H21N5O2S/c1-14-9-11-17(12-10-14)23-20(24-19-21-15(2)13-16(3)22-19)25-28(26,27)18-7-5-4-6-8-18/h4-13H,1-3H3,(H2,21,22,23,24,25)