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

Systemtic Name: 4-chloranyl-N-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide CAS Name: 4-chloro-N-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-phenylpropyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylpropyl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-phenyl-propyl]benzenesulfonamide Formula: C18H19ClN4O2S2 MolecularWeight: 422.95206

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCCC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C=NN=C1SCCC(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN4O2S2/c1-23-13-20-21-18(23)26-12-11-17(14-5-3-2-4-6-14)22-27(24,25)16-9-7-15(19)8-10-16/h2-10,13,17,22H,11-12H2,1H3