2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[2-(4-tert-butylphenoxy)ethyl]ethanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-[2-(4-tert-butylphenoxy)ethyl]ethanamide Openeye Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(4,6-diamino-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-(4,6-diaminopyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[2-(4-tert-butylphenoxy)ethyl]-2-[(4,6-diaminopyrimidin-2-yl)thio]acetamide Formula: C18H25N5O2S MolecularWeight: 375.4884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N5O2S/c1-18(2,3)12-4-6-13(7-5-12)25-9-8-21-16(24)11-26-17-22-14(19)10-15(20)23-17/h4-7,10H,8-9,11H2,1-3H3,(H,21,24)(H4,19,20,22,23)