2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(4-tert-butylphenyl)propanamide

Systemtic Name: 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanyl-N-(4-tert-butylphenyl)propanamide Openeye Name: N-(4-tert-butylphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanyl-propanamide CAS Name: N-(4-tert-butylphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]propanamide IUPAC Name: N-(4-tert-butylphenyl)-2-(4,6-diaminopyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(4-tert-butylphenyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]propionamide Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)SC2=NC(=CC(=N2)N)N

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)SC2=NC(=CC(=N2)N)N

InChI

InChI=1S/C17H23N5OS/c1-10(24-16-21-13(18)9-14(19)22-16)15(23)20-12-7-5-11(6-8-12)17(2,3)4/h5-10H,1-4H3,(H,20,23)(H4,18,19,21,22)