4-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-[4-(2-methylphenyl)butanoyl]benzenesulfonamide

Systemtic Name: 4-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-[4-(2-methylphenyl)butanoyl]benzenesulfonamide Openeye Name: 4-[2-cyano-5-(3-thienylmethoxy)phenoxy]-2-[4-(o-tolyl)butanoyl]benzenesulfonamide CAS Name: 4-[2-cyano-5-(3-thiophenylmethoxy)phenoxy]-2-[4-(2-methylphenyl)-1-oxobutyl]benzenesulfonamide IUPAC Name: 4-[2-cyano-5-(thiophen-3-ylmethoxy)phenoxy]-2-[4-(2-methylphenyl)butanoyl]benzenesulfonamide Traditional Name: 4-[2-cyano-5-(3-thenyloxy)phenoxy]-2-[4-(o-tolyl)butanoyl]benzenesulfonamide Formula: C29H26N2O5S2 MolecularWeight: 546.65714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCCC(=O)C2=C(C=CC(=C2)OC3=C(C=CC(=C3)OCC4=CSC=C4)C#N)S(=O)(=O)N

Isomeric SMILES

CC1=CC=CC=C1CCCC(=O)C2=C(C=CC(=C2)OC3=C(C=CC(=C3)OCC4=CSC=C4)C#N)S(=O)(=O)N

InChI

InChI=1S/C29H26N2O5S2/c1-20-5-2-3-6-22(20)7-4-8-27(32)26-15-25(11-12-29(26)38(31,33)34)36-28-16-24(10-9-23(28)17-30)35-18-21-13-14-37-19-21/h2-3,5-6,9-16,19H,4,7-8,18H2,1H3,(H2,31,33,34)