(2S)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide

Systemtic Name: (2S)-2-(4-azanyl-6-methyl-pyrimidin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide Openeye Name: (2S)-2-(4-amino-6-methyl-pyrimidin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide CAS Name: (2S)-2-[(4-amino-6-methyl-2-pyrimidinyl)thio]-N-(4-ethoxyphenyl)propanamide IUPAC Name: (2S)-2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-(4-ethoxyphenyl)propanamide Traditional Name: (2S)-2-[(4-amino-6-methyl-pyrimidin-2-yl)thio]-N-p-phenetyl-propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(C)SC2=NC(=CC(=N2)N)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=NC(=CC(=N2)N)C

InChI

InChI=1S/C16H20N4O2S/c1-4-22-13-7-5-12(6-8-13)19-15(21)11(3)23-16-18-10(2)9-14(17)20-16/h5-9,11H,4H2,1-3H3,(H,19,21)(H2,17,18,20)/t11-/m0/s1