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

Systemtic Name: 4-chloranyl-N-[3-(3-cyano-1,2,4-triazol-1-yl)-1-phenyl-propyl]benzenesulfonamide Openeye Name: 4-chloro-N-[3-(3-cyano-1,2,4-triazol-1-yl)-1-phenyl-propyl]benzenesulfonamide CAS Name: 4-chloro-N-[3-(3-cyano-1,2,4-triazol-1-yl)-1-phenylpropyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-(3-cyano-1,2,4-triazol-1-yl)-1-phenylpropyl]benzenesulfonamide Traditional Name: 4-chloro-N-[3-(3-cyano-1,2,4-triazol-1-yl)-1-phenyl-propyl]benzenesulfonamide Formula: C18H16ClN5O2S MolecularWeight: 401.86994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCN2C=NC(=N2)C#N)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(CCN2C=NC(=N2)C#N)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H16ClN5O2S/c19-15-6-8-16(9-7-15)27(25,26)23-17(14-4-2-1-3-5-14)10-11-24-13-21-18(12-20)22-24/h1-9,13,17,23H,10-11H2