4-bromanyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[2-methyl-4-[(phenylthio)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[2-methyl-4-(phenylsulfanylmethyl)phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-[2-methyl-4-[(phenylthio)methyl]phenyl]benzenesulfonamide Formula: C20H18BrNO2S2 MolecularWeight: 448.39642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)CSC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H18BrNO2S2/c1-15-13-16(14-25-18-5-3-2-4-6-18)7-12-20(15)22-26(23,24)19-10-8-17(21)9-11-19/h2-13,22H,14H2,1H3