2-[(5-butyl-4-oxidanylidene-6-phenyl-1,3-diazinan-2-yl)sulfanyl]ethanamide

Systemtic Name: 2-[(5-butyl-4-oxidanylidene-6-phenyl-1,3-diazinan-2-yl)sulfanyl]ethanamide Openeye Name: 2-(5-butyl-4-oxo-6-phenyl-hexahydropyrimidin-2-yl)sulfanylacetamide CAS Name: 2-[(5-butyl-4-oxo-6-phenyl-1,3-diazinan-2-yl)thio]acetamide IUPAC Name: 2-[(5-butyl-4-oxo-6-phenyl-1,3-diazinan-2-yl)sulfanyl]acetamide Traditional Name: 2-[(5-butyl-4-keto-6-phenyl-hexahydropyrimidin-2-yl)thio]acetamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(NC(NC1=O)SCC(=O)N)C2=CC=CC=C2

Isomeric SMILES

CCCCC1C(NC(NC1=O)SCC(=O)N)C2=CC=CC=C2

InChI

InChI=1S/C16H23N3O2S/c1-2-3-9-12-14(11-7-5-4-6-8-11)18-16(19-15(12)21)22-10-13(17)20/h4-8,12,14,16,18H,2-3,9-10H2,1H3,(H2,17,20)(H,19,21)