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

Systemtic Name: 1-(3,4-dimethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-(4-methylphenyl)sulfonyl-guanidine Openeye Name: 1-(3,4-dimethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-(p-tolylsulfonyl)guanidine CAS Name: 1-(3,4-dimethylphenyl)-2-(4,6-dimethyl-2-pyrimidinyl)-1-(4-methylphenyl)sulfonylguanidine IUPAC Name: 1-(3,4-dimethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-(4-methylphenyl)sulfonylguanidine Traditional Name: 1-(3,4-dimethylphenyl)-2-(4,6-dimethylpyrimidin-2-yl)-1-tosyl-guanidine Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C2=CC(=C(C=C2)C)C)/C(=N/C3=NC(=CC(=N3)C)C)/N

InChI

InChI=1S/C22H25N5O2S/c1-14-6-10-20(11-7-14)30(28,29)27(19-9-8-15(2)16(3)12-19)21(23)26-22-24-17(4)13-18(5)25-22/h6-13H,1-5H3,(H2,23,24,25,26)