2-cyano-3-(2-phenylethanoyl)-4-propan-2-yl-5-[3-(thiophen-3-ylmethoxy)phenoxy]benzenesulfonamide

Systemtic Name: 2-cyano-3-(2-phenylethanoyl)-4-propan-2-yl-5-[3-(thiophen-3-ylmethoxy)phenoxy]benzenesulfonamide Openeye Name: 2-cyano-4-isopropyl-3-(2-phenylacetyl)-5-[3-(3-thienylmethoxy)phenoxy]benzenesulfonamide CAS Name: 2-cyano-3-(1-oxo-2-phenylethyl)-4-propan-2-yl-5-[3-(3-thiophenylmethoxy)phenoxy]benzenesulfonamide IUPAC Name: 2-cyano-3-(2-phenylacetyl)-4-propan-2-yl-5-[3-(thiophen-3-ylmethoxy)phenoxy]benzenesulfonamide Traditional Name: 2-cyano-4-isopropyl-3-(2-phenylacetyl)-5-[3-(3-thenyloxy)phenoxy]benzenesulfonamide Formula: C29H26N2O5S2 MolecularWeight: 546.65714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(C=C1OC2=CC(=CC=C2)OCC3=CSC=C3)S(=O)(=O)N)C#N)C(=O)CC4=CC=CC=C4

Isomeric SMILES

CC(C)C1=C(C(=C(C=C1OC2=CC(=CC=C2)OCC3=CSC=C3)S(=O)(=O)N)C#N)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C29H26N2O5S2/c1-19(2)28-26(36-23-10-6-9-22(14-23)35-17-21-11-12-37-18-21)15-27(38(31,33)34)24(16-30)29(28)25(32)13-20-7-4-3-5-8-20/h3-12,14-15,18-19H,13,17H2,1-2H3,(H2,31,33,34)