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

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[(3-bromophenyl)methylthio]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[(3-bromobenzyl)thio]-1,4,5,6-tetrahydropyrimidine Formula: C11H13BrN2S MolecularWeight: 285.20332

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)SCC2=CC(=CC=C2)Br

Isomeric SMILES

C1CNC(=NC1)SCC2=CC(=CC=C2)Br

InChI

InChI=1S/C11H13BrN2S/c12-10-4-1-3-9(7-10)8-15-11-13-5-2-6-14-11/h1,3-4,7H,2,5-6,8H2,(H,13,14)