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

Systemtic Name: 3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: 3-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-phenyl-propanamide CAS Name: 3-[(4,6-diamino-2-pyrimidinyl)thio]-N-phenylpropanamide IUPAC Name: 3-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-phenylpropanamide Traditional Name: 3-[(4,6-diaminopyrimidin-2-yl)thio]-N-phenyl-propionamide Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N5OS/c14-10-8-11(15)18-13(17-10)20-7-6-12(19)16-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,16,19)(H4,14,15,17,18)