1-(4-aminophenyl)sulfonyl-1-[2-[(3-bromanylpyridin-2-yl)methylsulfanyl]ethyl]-2-methyl-guanidine

Systemtic Name: 1-(4-aminophenyl)sulfonyl-1-[2-[(3-bromanylpyridin-2-yl)methylsulfanyl]ethyl]-2-methyl-guanidine Openeye Name: 1-(4-aminophenyl)sulfonyl-1-[2-[(3-bromo-2-pyridyl)methylsulfanyl]ethyl]-2-methyl-guanidine CAS Name: 1-(4-aminophenyl)sulfonyl-1-[2-[(3-bromo-2-pyridinyl)methylthio]ethyl]-2-methylguanidine IUPAC Name: 1-(4-aminophenyl)sulfonyl-1-[2-[(3-bromopyridin-2-yl)methylsulfanyl]ethyl]-2-methylguanidine Traditional Name: 1-[2-[(3-bromo-2-pyridyl)methylthio]ethyl]-2-methyl-1-sulfanilyl-guanidine Formula: C16H20BrN5O2S2 MolecularWeight: 458.3963

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CCSCC1=C(C=CC=N1)Br)S(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CN=C(N)N(CCSCC1=C(C=CC=N1)Br)S(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C16H20BrN5O2S2/c1-20-16(19)22(26(23,24)13-6-4-12(18)5-7-13)9-10-25-11-15-14(17)3-2-8-21-15/h2-8H,9-11,18H2,1H3,(H2,19,20)