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

Systemtic Name: 2-methylpropyl 2-[1-methyl-4,6-bis(oxidanylidene)-5-phenyl-2-sulfanylidene-1,3-diazinan-5-yl]ethanoate Openeye Name: isobutyl 2-(1-methyl-4,6-dioxo-5-phenyl-2-thioxo-hexahydropyrimidin-5-yl)acetate CAS Name: 2-(1-methyl-4,6-dioxo-5-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-(1-methyl-4,6-dioxo-5-phenyl-2-sulfanylidene-1,3-diazinan-5-yl)acetate Traditional Name: 2-(4,6-diketo-1-methyl-5-phenyl-2-thioxo-hexahydropyrimidin-5-yl)acetic acid isobutyl ester Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CC1(C(=O)NC(=S)N(C1=O)C)C2=CC=CC=C2

Isomeric SMILES

CC(C)COC(=O)CC1(C(=O)NC(=S)N(C1=O)C)C2=CC=CC=C2

InChI

InChI=1S/C17H20N2O4S/c1-11(2)10-23-13(20)9-17(12-7-5-4-6-8-12)14(21)18-16(24)19(3)15(17)22/h4-8,11H,9-10H2,1-3H3,(H,18,21,24)