3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-pyridin-3-yl-propanamide

Systemtic Name: 3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-pyridin-3-yl-propanamide Openeye Name: 3-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(3-pyridyl)propanamide CAS Name: 3-[(4,6-diamino-2-pyrimidinyl)thio]-N-(3-pyridinyl)propanamide IUPAC Name: 3-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-pyridin-3-ylpropanamide Traditional Name: 3-[(4,6-diaminopyrimidin-2-yl)thio]-N-(3-pyridyl)propionamide Formula: C12H14N6OS MolecularWeight: 290.34416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)CCSC2=NC(=CC(=N2)N)N

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)CCSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C12H14N6OS/c13-9-6-10(14)18-12(17-9)20-5-3-11(19)16-8-2-1-4-15-7-8/h1-2,4,6-7H,3,5H2,(H,16,19)(H4,13,14,17,18)