2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-cyclopropyl-2-phenylacetamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C16H15N5OS MolecularWeight: 325.3882

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C(C2=CC=CC=C2)SC3=NC=C(C(=N3)N)C#N

Isomeric SMILES

C1CC1NC(=O)C(C2=CC=CC=C2)SC3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C16H15N5OS/c17-8-11-9-19-16(21-14(11)18)23-13(10-4-2-1-3-5-10)15(22)20-12-6-7-12/h1-5,9,12-13H,6-7H2,(H,20,22)(H2,18,19,21)