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

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-2-(phenylsulfonyl)-3-(4-propan-2-ylphenyl)guanidine Openeye Name: 2-(benzenesulfonyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-(4-isopropylphenyl)guanidine CAS Name: 2-(benzenesulfonyl)-1-(4,6-dimethyl-2-pyrimidinyl)-3-(4-propan-2-ylphenyl)guanidine IUPAC Name: 2-(benzenesulfonyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-(4-propan-2-ylphenyl)guanidine Traditional Name: 2-besyl-1-(4,6-dimethylpyrimidin-2-yl)-3-p-cumenyl-guanidine Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=NS(=O)(=O)C2=CC=CC=C2)NC3=CC=C(C=C3)C(C)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)N/C(=N\S(=O)(=O)C2=CC=CC=C2)/NC3=CC=C(C=C3)C(C)C)C

InChI

InChI=1S/C22H25N5O2S/c1-15(2)18-10-12-19(13-11-18)25-22(26-21-23-16(3)14-17(4)24-21)27-30(28,29)20-8-6-5-7-9-20/h5-15H,1-4H3,(H2,23,24,25,26,27)