(E)-7-phenyl-2-phenylsulfanyl-7-pyridin-3-yl-hept-6-enoic acid

Systemtic Name: (E)-7-phenyl-2-phenylsulfanyl-7-pyridin-3-yl-hept-6-enoic acid Openeye Name: (E)-7-phenyl-2-phenylsulfanyl-7-(3-pyridyl)hept-6-enoic acid CAS Name: (E)-7-phenyl-2-(phenylthio)-7-(3-pyridinyl)-6-heptenoic acid IUPAC Name: (E)-7-phenyl-2-phenylsulfanyl-7-pyridin-3-ylhept-6-enoic acid Traditional Name: (E)-7-phenyl-2-(phenylthio)-7-(3-pyridyl)hept-6-enoic acid Formula: C24H23NO2S MolecularWeight: 389.50992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CCCCC(C(=O)O)SC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\CCCC(C(=O)O)SC2=CC=CC=C2)/C3=CN=CC=C3

InChI

InChI=1S/C24H23NO2S/c26-24(27)23(28-21-13-5-2-6-14-21)16-8-7-15-22(19-10-3-1-4-11-19)20-12-9-17-25-18-20/h1-6,9-15,17-18,23H,7-8,16H2,(H,26,27)/b22-15+