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

Systemtic Name: 1-(4-butylphenyl)-2-(4-chlorophenyl)sulfonyl-3-(4,6-dimethylpyrimidin-2-yl)guanidine Openeye Name: 1-(4-butylphenyl)-2-(4-chlorophenyl)sulfonyl-3-(4,6-dimethylpyrimidin-2-yl)guanidine CAS Name: 1-(4-butylphenyl)-2-(4-chlorophenyl)sulfonyl-3-(4,6-dimethyl-2-pyrimidinyl)guanidine IUPAC Name: 1-(4-butylphenyl)-2-(4-chlorophenyl)sulfonyl-3-(4,6-dimethylpyrimidin-2-yl)guanidine Traditional Name: 1-(4-butylphenyl)-2-(4-chlorophenyl)sulfonyl-3-(4,6-dimethylpyrimidin-2-yl)guanidine Formula: C23H26ClN5O2S MolecularWeight: 472.00284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=NS(=O)(=O)C2=CC=C(C=C2)Cl)NC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N/C(=N/S(=O)(=O)C2=CC=C(C=C2)Cl)/NC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C23H26ClN5O2S/c1-4-5-6-18-7-11-20(12-8-18)27-23(28-22-25-16(2)15-17(3)26-22)29-32(30,31)21-13-9-19(24)10-14-21/h7-15H,4-6H2,1-3H3,(H2,25,26,27,28,29)