2-[2,5-bis(bromanyl)phenyl]-1-methyl-1-(3-methylsulfonylphenyl)guanidine hydrochloride

Systemtic Name: 2-[2,5-bis(bromanyl)phenyl]-1-methyl-1-(3-methylsulfonylphenyl)guanidine hydrochloride Openeye Name: 2-(2,5-dibromophenyl)-1-methyl-1-(3-methylsulfonylphenyl)guanidine hydrochloride CAS Name: 2-(2,5-dibromophenyl)-1-methyl-1-(3-methylsulfonylphenyl)guanidine hydrochloride IUPAC Name: 2-(2,5-dibromophenyl)-1-methyl-1-(3-methylsulfonylphenyl)guanidine hydrochloride Traditional Name: 2-(2,5-dibromophenyl)-1-(3-mesylphenyl)-1-methyl-guanidine hydrochloride Formula: C15H16Br2ClN3O2S MolecularWeight: 497.63244

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC(=CC=C1)S(=O)(=O)C)C(=NC2=C(C=CC(=C2)Br)Br)N.Cl

Isomeric SMILES

CN(C1=CC(=CC=C1)S(=O)(=O)C)C(=NC2=C(C=CC(=C2)Br)Br)N.Cl

InChI

InChI=1S/C15H15Br2N3O2S.ClH/c1-20(11-4-3-5-12(9-11)23(2,21)22)15(18)19-14-8-10(16)6-7-13(14)17;/h3-9H,1-2H3,(H2,18,19);1H