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

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-guanidine Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(p-tolyl)-2-(p-tolylsulfonyl)guanidine CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-3-(4-methylphenyl)-2-(4-methylphenyl)sulfonylguanidine IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-methylphenyl)-2-(4-methylphenyl)sulfonylguanidine Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-(p-tolyl)-2-tosyl-guanidine Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=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/C21H23N5O2S/c1-14-5-9-18(10-6-14)24-21(25-20-22-16(3)13-17(4)23-20)26-29(27,28)19-11-7-15(2)8-12-19/h5-13H,1-4H3,(H2,22,23,24,25,26)