1-[3-(4-aminophenyl)sulfonyl-5-bromanyl-phenyl]-N'-methyl-propane-1,3-diamine

Systemtic Name: 1-[3-(4-aminophenyl)sulfonyl-5-bromanyl-phenyl]-N'-methyl-propane-1,3-diamine Openeye Name: 1-[3-(4-aminophenyl)sulfonyl-5-bromo-phenyl]-N'-methyl-propane-1,3-diamine CAS Name: 1-[3-(4-aminophenyl)sulfonyl-5-bromophenyl]-N'-methylpropane-1,3-diamine IUPAC Name: 1-[3-(4-aminophenyl)sulfonyl-5-bromophenyl]-N'-methylpropane-1,3-diamine Traditional Name: [3-amino-3-(3-bromo-5-sulfanilyl-phenyl)propyl]-methyl-amine Formula: C16H20BrN3O2S MolecularWeight: 398.3179

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1=CC(=CC(=C1)Br)S(=O)(=O)C2=CC=C(C=C2)N)N

Isomeric SMILES

CNCCC(C1=CC(=CC(=C1)Br)S(=O)(=O)C2=CC=C(C=C2)N)N

InChI

InChI=1S/C16H20BrN3O2S/c1-20-7-6-16(19)11-8-12(17)10-15(9-11)23(21,22)14-4-2-13(18)3-5-14/h2-5,8-10,16,20H,6-7,18-19H2,1H3