1-adamantylmethyl 2-[5-cyclopent-2-en-1-yl-1-methyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]ethanoate

Systemtic Name: 1-adamantylmethyl 2-[5-cyclopent-2-en-1-yl-1-methyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]ethanoate Openeye Name: 1-adamantylmethyl 2-(5-cyclopent-2-en-1-yl-1-methyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)acetate CAS Name: 2-[5-(1-cyclopent-2-enyl)-1-methyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]acetic acid 1-adamantylmethyl ester IUPAC Name: 1-adamantylmethyl 2-(5-cyclopent-2-en-1-yl-1-methyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl)acetate Traditional Name: 2-(5-cyclopent-2-en-1-yl-4,6-diketo-1-methyl-2-thioxo-hexahydropyrimidin-5-yl)acetic acid 1-adamantylmethyl ester Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)NC1=S)(CC(=O)OCC23CC4CC(C2)CC(C4)C3)C5CCC=C5

Isomeric SMILES

CN1C(=O)C(C(=O)NC1=S)(CC(=O)OCC23CC4CC(C2)CC(C4)C3)C5CCC=C5

InChI

InChI=1S/C23H30N2O4S/c1-25-20(28)23(17-4-2-3-5-17,19(27)24-21(25)30)12-18(26)29-13-22-9-14-6-15(10-22)8-16(7-14)11-22/h2,4,14-17H,3,5-13H2,1H3,(H,24,27,30)