N-[3-(4-methylphenyl)sulfanyl-5-nitro-phenyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide

Systemtic Name: N-[3-(4-methylphenyl)sulfanyl-5-nitro-phenyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide Openeye Name: N-[3-nitro-5-(p-tolylsulfanyl)phenyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide CAS Name: N-[3-[(4-methylphenyl)thio]-5-nitrophenyl]-5-[(4-propylphenoxy)methyl]-2-furancarboxamide IUPAC Name: N-[3-(4-methylphenyl)sulfanyl-5-nitrophenyl]-5-[(4-propylphenoxy)methyl]furan-2-carboxamide Traditional Name: N-[3-nitro-5-(p-tolylthio)phenyl]-5-[(4-propylphenoxy)methyl]-2-furamide Formula: C28H26N2O5S MolecularWeight: 502.58144

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC2=CC=C(O2)C(=O)NC3=CC(=CC(=C3)SC4=CC=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C28H26N2O5S/c1-3-4-20-7-9-23(10-8-20)34-18-24-11-14-27(35-24)28(31)29-21-15-22(30(32)33)17-26(16-21)36-25-12-5-19(2)6-13-25/h5-17H,3-4,18H2,1-2H3,(H,29,31)