N-(3-cyano-4,5-diphenyl-furan-2-yl)-3-(4,8-dimethylquinolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-cyano-4,5-diphenyl-furan-2-yl)-3-(4,8-dimethylquinolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-cyano-4,5-diphenyl-2-furyl)-3-[(4,8-dimethyl-2-quinolyl)sulfanyl]propanamide CAS Name: N-(3-cyano-4,5-diphenyl-2-furanyl)-3-[(4,8-dimethyl-2-quinolinyl)thio]propanamide IUPAC Name: N-(3-cyano-4,5-diphenylfuran-2-yl)-3-(4,8-dimethylquinolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-cyano-4,5-diphenyl-2-furyl)-3-[(4,8-dimethyl-2-quinolyl)thio]propionamide Formula: C31H25N3O2S MolecularWeight: 503.6141

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)NC3=C(C(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCCC(=O)NC3=C(C(=C(O3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C31H25N3O2S/c1-20-10-9-15-24-21(2)18-27(34-29(20)24)37-17-16-26(35)33-31-25(19-32)28(22-11-5-3-6-12-22)30(36-31)23-13-7-4-8-14-23/h3-15,18H,16-17H2,1-2H3,(H,33,35)