6-azanyl-2-(quinolin-8-ylmethylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-(quinolin-8-ylmethylsulfanyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-2-(8-quinolylmethylsulfanyl)-1H-pyrimidin-4-one CAS Name: 6-amino-2-(8-quinolinylmethylthio)-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-(quinolin-8-ylmethylsulfanyl)-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(8-quinolylmethylthio)-1H-pyrimidin-4-one Formula: C14H12N4OS MolecularWeight: 284.33628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CSC3=NC(=O)C=C(N3)N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CSC3=NC(=O)C=C(N3)N)N=CC=C2

InChI

InChI=1S/C14H12N4OS/c15-11-7-12(19)18-14(17-11)20-8-10-4-1-3-9-5-2-6-16-13(9)10/h1-7H,8H2,(H3,15,17,18,19)