2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]methylidene]-N-(2-methylphenyl)-3-oxidanylidene-butanamide

Systemtic Name: 2-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-1-yl]methylidene]-N-(2-methylphenyl)-3-oxidanylidene-butanamide Openeye Name: 2-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-1-yl)methylene]-N-(o-tolyl)-3-oxo-butanamide CAS Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl)methylidene]-N-(2-methylphenyl)-3-oxobutanamide IUPAC Name: 2-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-1-yl)methylidene]-N-(2-methylphenyl)-3-oxobutanamide Traditional Name: 2-acetyl-3-(4,6-diketo-2-thioxo-hexahydropyrimidin-1-yl)-N-(o-tolyl)acrylamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(=CN2C(=O)CC(=O)NC2=S)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(=CN2C(=O)CC(=O)NC2=S)C(=O)C

InChI

InChI=1S/C16H15N3O4S/c1-9-5-3-4-6-12(9)17-15(23)11(10(2)20)8-19-14(22)7-13(21)18-16(19)24/h3-6,8H,7H2,1-2H3,(H,17,23)(H,18,21,24)