N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-[(4-fluorophenyl)thio]propionamide Formula: C20H19FN2O3S2 MolecularWeight: 418.504863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CCSC3=CC=C(C=C3)F)OC

InChI

InChI=1S/C20H19FN2O3S2/c1-25-17-8-3-13(11-18(17)26-2)16-12-28-20(22-16)23-19(24)9-10-27-15-6-4-14(21)5-7-15/h3-8,11-12H,9-10H2,1-2H3,(H,22,23,24)