2-[(4-bromophenyl)methylsulfanyl]-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-5-(morpholinomethyl)-1H-pyrimidin-6-one CAS Name: 2-[(4-bromophenyl)methylthio]-5-(4-morpholinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[(4-bromobenzyl)thio]-5-(morpholinomethyl)-1H-pyrimidin-6-one Formula: C16H18BrN3O2S MolecularWeight: 396.30202

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)Br

Isomeric SMILES

C1COCCN1CC2=CN=C(NC2=O)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H18BrN3O2S/c17-14-3-1-12(2-4-14)11-23-16-18-9-13(15(21)19-16)10-20-5-7-22-8-6-20/h1-4,9H,5-8,10-11H2,(H,18,19,21)