N-(3-cyclohexylsulfanylpropyl)-2-[(4-methoxy-3-methyl-phenyl)sulfonyl-phenyl-amino]ethanamide

Systemtic Name: N-(3-cyclohexylsulfanylpropyl)-2-[(4-methoxy-3-methyl-phenyl)sulfonyl-phenyl-amino]ethanamide Openeye Name: N-(3-cyclohexylsulfanylpropyl)-2-(N-(4-methoxy-3-methyl-phenyl)sulfonylanilino)acetamide CAS Name: N-[3-(cyclohexylthio)propyl]-2-(N-(4-methoxy-3-methylphenyl)sulfonylanilino)acetamide IUPAC Name: N-(3-cyclohexylsulfanylpropyl)-2-(N-(4-methoxy-3-methylphenyl)sulfonylanilino)acetamide Traditional Name: N-[3-(cyclohexylthio)propyl]-2-(N-(4-methoxy-3-methyl-phenyl)sulfonylanilino)acetamide Formula: C25H34N2O4S2 MolecularWeight: 490.67846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N(CC(=O)NCCCSC2CCCCC2)C3=CC=CC=C3)OC

InChI

InChI=1S/C25H34N2O4S2/c1-20-18-23(14-15-24(20)31-2)33(29,30)27(21-10-5-3-6-11-21)19-25(28)26-16-9-17-32-22-12-7-4-8-13-22/h3,5-6,10-11,14-15,18,22H,4,7-9,12-13,16-17,19H2,1-2H3,(H,26,28)