4-(4-cyano-2-methoxy-phenoxy)-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]butanamide

Systemtic Name: 4-(4-cyano-2-methoxy-phenoxy)-N-[(4-fluorophenyl)-thiophen-2-yl-methyl]butanamide Openeye Name: 4-(4-cyano-2-methoxy-phenoxy)-N-[(4-fluorophenyl)-(2-thienyl)methyl]butanamide CAS Name: 4-(4-cyano-2-methoxyphenoxy)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]butanamide IUPAC Name: 4-(4-cyano-2-methoxyphenoxy)-N-[(4-fluorophenyl)-thiophen-2-ylmethyl]butanamide Traditional Name: 4-(4-cyano-2-methoxy-phenoxy)-N-[(4-fluorophenyl)-(2-thienyl)methyl]butyramide Formula: C23H21FN2O3S MolecularWeight: 424.487843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCCCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCCCC(=O)NC(C2=CC=C(C=C2)F)C3=CC=CS3

InChI

InChI=1S/C23H21FN2O3S/c1-28-20-14-16(15-25)6-11-19(20)29-12-2-5-22(27)26-23(21-4-3-13-30-21)17-7-9-18(24)10-8-17/h3-4,6-11,13-14,23H,2,5,12H2,1H3,(H,26,27)