(E)-3-[3-phenethyloxy-6-(phenylsulfanylmethyl)pyridin-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-phenethyloxy-6-(phenylsulfanylmethyl)pyridin-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[3-phenethyloxy-6-(phenylsulfanylmethyl)-2-pyridyl]prop-2-enoic acid CAS Name: (E)-3-[3-phenethyloxy-6-[(phenylthio)methyl]-2-pyridinyl]-2-propenoic acid IUPAC Name: (E)-3-[3-phenethyloxy-6-(phenylsulfanylmethyl)pyridin-2-yl]prop-2-enoic acid Traditional Name: (E)-3-[3-phenethyloxy-6-[(phenylthio)methyl]-2-pyridyl]acrylic acid Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(N=C(C=C2)CSC3=CC=CC=C3)C=CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(N=C(C=C2)CSC3=CC=CC=C3)/C=C/C(=O)O

InChI

InChI=1S/C23H21NO3S/c25-23(26)14-12-21-22(27-16-15-18-7-3-1-4-8-18)13-11-19(24-21)17-28-20-9-5-2-6-10-20/h1-14H,15-17H2,(H,25,26)/b14-12+