4-chloranyl-N-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-(1-methyltetrazol-5-yl)sulfanyl-1-phenyl-propyl]benzenesulfonamide CAS Name: 4-chloro-N-[3-[(1-methyl-5-tetrazolyl)thio]-1-phenylpropyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-(1-methyltetrazol-5-yl)sulfanyl-1-phenylpropyl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-[(1-methyltetrazol-5-yl)thio]-1-phenyl-propyl]benzenesulfonamide Formula: C17H18ClN5O2S2 MolecularWeight: 423.94012

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCCC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=NN=N1)SCCC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H18ClN5O2S2/c1-23-17(19-21-22-23)26-12-11-16(13-5-3-2-4-6-13)20-27(24,25)15-9-7-14(18)8-10-15/h2-10,16,20H,11-12H2,1H3