(2S)-2-[(5-ethanoyl-6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-N-(4-ethylphenyl)propanamide

Systemtic Name: (2S)-2-[(5-ethanoyl-6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]-N-(4-ethylphenyl)propanamide Openeye Name: (2S)-2-[(5-acetyl-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]-N-(4-ethylphenyl)propanamide CAS Name: (2S)-2-[(5-acetyl-6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]-N-(4-ethylphenyl)propanamide IUPAC Name: (2S)-2-[(5-acetyl-6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]-N-(4-ethylphenyl)propanamide Traditional Name: (2S)-2-[(5-acetyl-2-keto-6-methyl-1H-pyrimidin-4-yl)thio]-N-(4-ethylphenyl)propionamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NC(=O)NC(=C2C(=O)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=NC(=O)NC(=C2C(=O)C)C

InChI

InChI=1S/C18H21N3O3S/c1-5-13-6-8-14(9-7-13)20-16(23)12(4)25-17-15(11(3)22)10(2)19-18(24)21-17/h6-9,12H,5H2,1-4H3,(H,20,23)(H,19,21,24)/t12-/m0/s1