2-[3-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[(4-bromanyl-1H-imidazol-5-yl)methylsulfanyl]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[3-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[3-[(4-bromo-1H-imidazol-5-yl)methylthio]propylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[3-[(4-bromo-1H-imidazol-5-yl)methylsulfanyl]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[3-[(4-bromo-1H-imidazol-5-yl)methylthio]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C17H19BrN6OS MolecularWeight: 435.34136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCSCC3=C(N=CN3)Br

Isomeric SMILES

C1=CC(=CN=C1)CC2=CN=C(NC2=O)NCCCSCC3=C(N=CN3)Br

InChI

InChI=1S/C17H19BrN6OS/c18-15-14(22-11-23-15)10-26-6-2-5-20-17-21-9-13(16(25)24-17)7-12-3-1-4-19-8-12/h1,3-4,8-9,11H,2,5-7,10H2,(H,22,23)(H2,20,21,24,25)