N-[3-(4-methylphenyl)sulfanyl-5-nitro-phenyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide

Systemtic Name: N-[3-(4-methylphenyl)sulfanyl-5-nitro-phenyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide Openeye Name: 5-(1-naphthyloxymethyl)-N-[3-nitro-5-(p-tolylsulfanyl)phenyl]furan-2-carboxamide CAS Name: N-[3-[(4-methylphenyl)thio]-5-nitrophenyl]-5-(1-naphthalenyloxymethyl)-2-furancarboxamide IUPAC Name: N-[3-(4-methylphenyl)sulfanyl-5-nitrophenyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide Traditional Name: 5-(1-naphthoxymethyl)-N-[3-nitro-5-(p-tolylthio)phenyl]-2-furamide Formula: C29H22N2O5S MolecularWeight: 510.56038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)COC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=CC=C(O3)COC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C29H22N2O5S/c1-19-9-12-24(13-10-19)37-25-16-21(15-22(17-25)31(33)34)30-29(32)28-14-11-23(36-28)18-35-27-8-4-6-20-5-2-3-7-26(20)27/h2-17H,18H2,1H3,(H,30,32)