2-[(5-butyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[(5-butyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(1-phenylethyl)ethanamide Openeye Name: 2-[(5-butyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(1-phenylethyl)acetamide CAS Name: 2-[(5-butyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[(5-butyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(1-phenylethyl)acetamide Traditional Name: 2-[(5-butyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-(1-phenylethyl)acetamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(NC1=O)SCC(=O)NC(C)C2=CC=CC=C2)O

Isomeric SMILES

CCCCC1=C(N=C(NC1=O)SCC(=O)NC(C)C2=CC=CC=C2)O

InChI

InChI=1S/C18H23N3O3S/c1-3-4-10-14-16(23)20-18(21-17(14)24)25-11-15(22)19-12(2)13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3,(H,19,22)(H2,20,21,23,24)