N-[2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethyl]-4-chloranyl-benzenesulfonamide

Systemtic Name: N-[2-[(4-azanyl-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethyl]-4-chloranyl-benzenesulfonamide Openeye Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-2-phenyl-ethyl]-4-chloro-benzenesulfonamide CAS Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)thio]-2-phenylethyl]-4-chlorobenzenesulfonamide IUPAC Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)sulfanyl]-2-phenylethyl]-4-chlorobenzenesulfonamide Traditional Name: N-[2-[(4-amino-1,2,4-triazol-3-yl)thio]-2-phenyl-ethyl]-4-chloro-benzenesulfonamide Formula: C16H16ClN5O2S2 MolecularWeight: 409.91354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)SC3=NN=CN3N

Isomeric SMILES

C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)Cl)SC3=NN=CN3N

InChI

InChI=1S/C16H16ClN5O2S2/c17-13-6-8-14(9-7-13)26(23,24)20-10-15(12-4-2-1-3-5-12)25-16-21-19-11-22(16)18/h1-9,11,15,20H,10,18H2