(5S,6R)-4-iodanyl-3-phenyl-6-(phenylmethylsulfanyl)-2-thia-1-azabicyclo[3.2.0]hept-3-en-7-one

Systemtic Name: (5S,6R)-4-iodanyl-3-phenyl-6-(phenylmethylsulfanyl)-2-thia-1-azabicyclo[3.2.0]hept-3-en-7-one Openeye Name: (5S,6R)-6-benzylsulfanyl-4-iodo-3-phenyl-2-thia-1-azabicyclo[3.2.0]hept-3-en-7-one CAS Name: (5S,6R)-4-iodo-3-phenyl-6-(phenylmethylthio)-2-thia-1-azabicyclo[3.2.0]hept-3-en-7-one IUPAC Name: (5S,6R)-6-benzylsulfanyl-4-iodo-3-phenyl-2-thia-1-azabicyclo[3.2.0]hept-3-en-7-one Traditional Name: (5S,6R)-6-(benzylthio)-4-iodo-3-phenyl-2-thia-1-azabicyclo[3.2.0]hept-3-en-7-one Formula: C18H14INOS2 MolecularWeight: 451.34433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2C3C(=C(SN3C2=O)C4=CC=CC=C4)I

Isomeric SMILES

C1=CC=C(C=C1)CS[C@@H]2[C@H]3C(=C(SN3C2=O)C4=CC=CC=C4)I

InChI

InChI=1S/C18H14INOS2/c19-14-15-17(22-11-12-7-3-1-4-8-12)18(21)20(15)23-16(14)13-9-5-2-6-10-13/h1-10,15,17H,11H2/t15-,17-/m1/s1