(2S)-N-(4-acetamidophenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-(4-acetamidophenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: (2S)-N-(4-acetamidophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: (2S)-N-(4-acetamidophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: (2S)-N-(4-acetamidophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: (2S)-N-(4-acetamidophenyl)-2-[(6-keto-1H-pyrimidin-2-yl)thio]propionamide Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)NC(=O)C)SC2=NC=CC(=O)N2

InChI

InChI=1S/C15H16N4O3S/c1-9(23-15-16-8-7-13(21)19-15)14(22)18-12-5-3-11(4-6-12)17-10(2)20/h3-9H,1-2H3,(H,17,20)(H,18,22)(H,16,19,21)/t9-/m0/s1