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

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(2-butan-2-ylphenyl)ethanamide Openeye Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(2-sec-butylphenyl)acetamide CAS Name: N-(2-butan-2-ylphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2-butan-2-ylphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]-N-(2-sec-butylphenyl)acetamide Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)CSC2=NC(=CC(=N2)N)N

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)CSC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C16H21N5OS/c1-3-10(2)11-6-4-5-7-12(11)19-15(22)9-23-16-20-13(17)8-14(18)21-16/h4-8,10H,3,9H2,1-2H3,(H,19,22)(H4,17,18,20,21)