1-[2-[(3-bromanylpyridin-2-yl)-methyl-amino]ethyl]-2-methyl-1-(phenylsulfonyl)guanidine

Systemtic Name: 1-[2-[(3-bromanylpyridin-2-yl)-methyl-amino]ethyl]-2-methyl-1-(phenylsulfonyl)guanidine Openeye Name: 1-(benzenesulfonyl)-1-[2-[(3-bromo-2-pyridyl)-methyl-amino]ethyl]-2-methyl-guanidine CAS Name: 1-(benzenesulfonyl)-1-[2-[(3-bromo-2-pyridinyl)-methylamino]ethyl]-2-methylguanidine IUPAC Name: 1-(benzenesulfonyl)-1-[2-[(3-bromopyridin-2-yl)-methylamino]ethyl]-2-methylguanidine Traditional Name: 1-besyl-1-[2-[(3-bromo-2-pyridyl)-methyl-amino]ethyl]-2-methyl-guanidine Formula: C16H20BrN5O2S MolecularWeight: 426.3313

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CCN(C)C1=C(C=CC=N1)Br)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN=C(N)N(CCN(C)C1=C(C=CC=N1)Br)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20BrN5O2S/c1-19-16(18)22(25(23,24)13-7-4-3-5-8-13)12-11-21(2)15-14(17)9-6-10-20-15/h3-10H,11-12H2,1-2H3,(H2,18,19)