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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(3-phenylpropyl)ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(3-phenylpropyl)acetamide CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]-N-(3-phenylpropyl)acetamide IUPAC Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(3-phenylpropyl)acetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(3-phenylpropyl)acetamide Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C15H19N5OS/c16-12-9-13(17)20-15(19-12)22-10-14(21)18-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9H,4,7-8,10H2,(H,18,21)(H4,16,17,19,20)