2,5-dimethyl-N-[2-[(4-nitrophenyl)methylsulfanyl]ethyl]furan-3-carboxamide

Systemtic Name: 2,5-dimethyl-N-[2-[(4-nitrophenyl)methylsulfanyl]ethyl]furan-3-carboxamide Openeye Name: 2,5-dimethyl-N-[2-[(4-nitrophenyl)methylsulfanyl]ethyl]furan-3-carboxamide CAS Name: 2,5-dimethyl-N-[2-[(4-nitrophenyl)methylthio]ethyl]-3-furancarboxamide IUPAC Name: 2,5-dimethyl-N-[2-[(4-nitrophenyl)methylsulfanyl]ethyl]furan-3-carboxamide Traditional Name: 2,5-dimethyl-N-[2-[(4-nitrobenzyl)thio]ethyl]-3-furamide Formula: C16H18N2O4S MolecularWeight: 334.39012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)NCCSCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)NCCSCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S/c1-11-9-15(12(2)22-11)16(19)17-7-8-23-10-13-3-5-14(6-4-13)18(20)21/h3-6,9H,7-8,10H2,1-2H3,(H,17,19)