2-[5-(3-methylbutyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]ethanoic acid

Systemtic Name: 2-[5-(3-methylbutyl)-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-yl]ethanoic acid Openeye Name: 2-(5-isopentyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-yl)acetic acid CAS Name: 2-[5-(3-methylbutyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]acetic acid IUPAC Name: 2-[5-(3-methylbutyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-yl]acetic acid Traditional Name: 2-(5-isoamyl-4,6-diketo-2-thioxo-hexahydropyrimidin-5-yl)acetic acid Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1(C(=O)NC(=S)NC1=O)CC(=O)O

Isomeric SMILES

CC(C)CCC1(C(=O)NC(=S)NC1=O)CC(=O)O

InChI

InChI=1S/C11H16N2O4S/c1-6(2)3-4-11(5-7(14)15)8(16)12-10(18)13-9(11)17/h6H,3-5H2,1-2H3,(H,14,15)(H2,12,13,16,17,18)