N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(4-phenoxybutylamino)butan-2-yl]furan-2-carboxamide

Systemtic Name: N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(4-phenoxybutylamino)butan-2-yl]furan-2-carboxamide Openeye Name: N-[(1S)-3-methylsulfanyl-1-(4-phenoxybutylcarbamoyl)propyl]furan-2-carboxamide CAS Name: N-[(2S)-4-(methylthio)-1-oxo-1-(4-phenoxybutylamino)butan-2-yl]-2-furancarboxamide IUPAC Name: N-[(2S)-4-methylsulfanyl-1-oxo-1-(4-phenoxybutylamino)butan-2-yl]furan-2-carboxamide Traditional Name: N-[(1S)-3-(methylthio)-1-(4-phenoxybutylcarbamoyl)propyl]-2-furamide Formula: C20H26N2O4S MolecularWeight: 390.49644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCCCOC1=CC=CC=C1)NC(=O)C2=CC=CO2

Isomeric SMILES

CSCC[C@@H](C(=O)NCCCCOC1=CC=CC=C1)NC(=O)C2=CC=CO2

InChI

InChI=1S/C20H26N2O4S/c1-27-15-11-17(22-20(24)18-10-7-14-26-18)19(23)21-12-5-6-13-25-16-8-3-2-4-9-16/h2-4,7-10,14,17H,5-6,11-13,15H2,1H3,(H,21,23)(H,22,24)/t17-/m0/s1