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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-cyclopentyl-2-phenyl-ethanamide Openeye Name: N-cyclopentyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-2-phenyl-acetamide CAS Name: N-cyclopentyl-2-[(4,6-diamino-2-pyrimidinyl)thio]-2-phenylacetamide IUPAC Name: N-cyclopentyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-2-phenylacetamide Traditional Name: N-cyclopentyl-2-[(4,6-diaminopyrimidin-2-yl)thio]-2-phenyl-acetamide Formula: C17H21N5OS MolecularWeight: 343.44654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C(C2=CC=CC=C2)SC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CCC(C1)NC(=O)C(C2=CC=CC=C2)SC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C17H21N5OS/c18-13-10-14(19)22-17(21-13)24-15(11-6-2-1-3-7-11)16(23)20-12-8-4-5-9-12/h1-3,6-7,10,12,15H,4-5,8-9H2,(H,20,23)(H4,18,19,21,22)