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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)C)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)N/C(=N/S(=O)(=O)C2=CC=C(C=C2)C)/NC3=NC(=CC(=N3)C)C

InChI

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