(E)-2-benzamido-3-[5-(4-methylsulfanylphenyl)furan-2-yl]prop-2-enoic acid

Systemtic Name: (E)-2-benzamido-3-[5-(4-methylsulfanylphenyl)furan-2-yl]prop-2-enoic acid Openeye Name: (E)-2-benzamido-3-[5-(4-methylsulfanylphenyl)-2-furyl]prop-2-enoic acid CAS Name: (E)-2-benzamido-3-[5-[4-(methylthio)phenyl]-2-furanyl]-2-propenoic acid IUPAC Name: (E)-2-benzamido-3-[5-(4-methylsulfanylphenyl)furan-2-yl]prop-2-enoic acid Traditional Name: (E)-2-benzamido-3-[5-[4-(methylthio)phenyl]-2-furyl]acrylic acid Formula: C21H17NO4S MolecularWeight: 379.42898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC=C(O2)C=C(C(=O)O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C(=O)O)/NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17NO4S/c1-27-17-10-7-14(8-11-17)19-12-9-16(26-19)13-18(21(24)25)22-20(23)15-5-3-2-4-6-15/h2-13H,1H3,(H,22,23)(H,24,25)/b18-13+