2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-cyclopropyl-N-[(2-fluorophenyl)methyl]ethanamide Openeye Name: N-cyclopropyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(2-fluorophenyl)methyl]acetamide CAS Name: N-cyclopropyl-2-[(4,6-diamino-2-pyrimidinyl)thio]-N-[(2-fluorophenyl)methyl]acetamide IUPAC Name: N-cyclopropyl-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-[(2-fluorophenyl)methyl]acetamide Traditional Name: N-cyclopropyl-2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(2-fluorobenzyl)acetamide Formula: C16H18FN5OS MolecularWeight: 347.410423

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CC=C2F)C(=O)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1CC1N(CC2=CC=CC=C2F)C(=O)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C16H18FN5OS/c17-12-4-2-1-3-10(12)8-22(11-5-6-11)15(23)9-24-16-20-13(18)7-14(19)21-16/h1-4,7,11H,5-6,8-9H2,(H4,18,19,20,21)