2-[(2-methoxy-5-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide

Systemtic Name: 2-[(2-methoxy-5-methyl-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-(3-phenylsulfanylpropyl)ethanamide Openeye Name: 2-[2-methoxy-5-methyl-N-(p-tolylsulfonyl)anilino]-N-(3-phenylsulfanylpropyl)acetamide CAS Name: 2-(2-methoxy-5-methyl-N-(4-methylphenyl)sulfonylanilino)-N-[3-(phenylthio)propyl]acetamide IUPAC Name: 2-(2-methoxy-5-methyl-N-(4-methylphenyl)sulfonylanilino)-N-(3-phenylsulfanylpropyl)acetamide Traditional Name: 2-(2-methoxy-5-methyl-N-tosyl-anilino)-N-[3-(phenylthio)propyl]acetamide Formula: C26H30N2O4S2 MolecularWeight: 498.6574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2=CC=CC=C2)C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCCSC2=CC=CC=C2)C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C26H30N2O4S2/c1-20-10-13-23(14-11-20)34(30,31)28(24-18-21(2)12-15-25(24)32-3)19-26(29)27-16-7-17-33-22-8-5-4-6-9-22/h4-6,8-15,18H,7,16-17,19H2,1-3H3,(H,27,29)