N-(4-butylphenyl)-2-[(2-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[(2-ethoxyphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(4-butylphenyl)-2-(2-ethoxy-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetamide CAS Name: N-(4-butylphenyl)-2-(2-ethoxy-N-[4-(methylthio)phenyl]sulfonylanilino)acetamide IUPAC Name: N-(4-butylphenyl)-2-(2-ethoxy-N-(4-methylsulfanylphenyl)sulfonylanilino)acetamide Traditional Name: N-(4-butylphenyl)-2-(2-ethoxy-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetamide Formula: C27H32N2O4S2 MolecularWeight: 512.68398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN(C2=CC=CC=C2OCC)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN(C2=CC=CC=C2OCC)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C27H32N2O4S2/c1-4-6-9-21-12-14-22(15-13-21)28-27(30)20-29(25-10-7-8-11-26(25)33-5-2)35(31,32)24-18-16-23(34-3)17-19-24/h7-8,10-19H,4-6,9,20H2,1-3H3,(H,28,30)