2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-quinolin-5-yl-propanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-quinolin-5-yl-propanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(5-quinolyl)propanamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(5-quinolinyl)propanamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-quinolin-5-ylpropanamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(5-quinolyl)propionamide Formula: C16H16N6OS MolecularWeight: 340.40284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=NC(=CC(=N3)N)N

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C=CC=N2)SC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C16H16N6OS/c1-9(24-16-21-13(17)8-14(18)22-16)15(23)20-12-6-2-5-11-10(12)4-3-7-19-11/h2-9H,1H3,(H,20,23)(H4,17,18,21,22)