2-methylpropyl 2-(4-oxidanylidene-6-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)ethanoate

Systemtic Name: 2-methylpropyl 2-(4-oxidanylidene-6-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)ethanoate Openeye Name: isobutyl 2-(4-oxo-6-phenyl-2-thioxo-hexahydropyrimidin-5-yl)acetate CAS Name: 2-(4-oxo-6-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(4-oxo-6-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)acetate Traditional Name: 2-(4-keto-6-phenyl-2-thioxo-hexahydropyrimidin-5-yl)acetic acid isobutyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CC1C(NC(=S)NC1=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)COC(=O)CC1C(NC(=S)NC1=O)C2=CC=CC=C2

InChI

InChI=1S/C16H20N2O3S/c1-10(2)9-21-13(19)8-12-14(11-6-4-3-5-7-11)17-16(22)18-15(12)20/h3-7,10,12,14H,8-9H2,1-2H3,(H2,17,18,20,22)