3-bromanyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide

Systemtic Name: 3-bromanyl-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide Openeye Name: 3-bromo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide CAS Name: 3-bromo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide IUPAC Name: 3-bromo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide Traditional Name: 3-bromo-N-[(1S)-1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzenesulfonamide Formula: C16H15BrN4O2S MolecularWeight: 407.2849

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NS(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)N2C=NC=N2)NS(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H15BrN4O2S/c1-12(20-24(22,23)16-4-2-3-14(17)9-16)13-5-7-15(8-6-13)21-11-18-10-19-21/h2-12,20H,1H3/t12-/m0/s1