2-[2-[(3-iodanylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[(3-iodanylphenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[(3-iodophenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[(3-iodophenyl)methylthio]phenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[(3-iodophenyl)methylsulfanyl]phenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[(3-iodobenzyl)thio]phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C17H17IN2S MolecularWeight: 408.29975

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)C2=CC=CC=C2SCC3=CC(=CC=C3)I

Isomeric SMILES

C1CNC(=NC1)C2=CC=CC=C2SCC3=CC(=CC=C3)I

InChI

InChI=1S/C17H17IN2S/c18-14-6-3-5-13(11-14)12-21-16-8-2-1-7-15(16)17-19-9-4-10-20-17/h1-3,5-8,11H,4,9-10,12H2,(H,19,20)