N-[4-[3-[(4-butylsulfanylphenyl)amino]propanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[3-[(4-butylsulfanylphenyl)amino]propanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[3-(4-butylsulfanylanilino)propanoyl]phenyl]methanesulfonamide CAS Name: N-[4-[3-[4-(butylthio)anilino]-1-oxopropyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[3-(4-butylsulfanylanilino)propanoyl]phenyl]methanesulfonamide Traditional Name: N-[4-[3-[4-(butylthio)anilino]propanoyl]phenyl]methanesulfonamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)NCCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CCCCSC1=CC=C(C=C1)NCCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C20H26N2O3S2/c1-3-4-15-26-19-11-9-17(10-12-19)21-14-13-20(23)16-5-7-18(8-6-16)22-27(2,24)25/h5-12,21-22H,3-4,13-15H2,1-2H3