2-[1-azanyl-4,6-bis(oxidanylidene)-2-propan-2-yl-5-sulfanyl-1,3,5-triazinan-2-yl]ethanoic acid

Systemtic Name: 2-[1-azanyl-4,6-bis(oxidanylidene)-2-propan-2-yl-5-sulfanyl-1,3,5-triazinan-2-yl]ethanoic acid Openeye Name: 2-(1-amino-2-isopropyl-4,6-dioxo-5-sulfanyl-1,3,5-triazinan-2-yl)acetic acid CAS Name: 2-(1-amino-5-mercapto-4,6-dioxo-2-propan-2-yl-1,3,5-triazinan-2-yl)acetic acid IUPAC Name: 2-(1-amino-4,6-dioxo-2-propan-2-yl-5-sulfanyl-1,3,5-triazinan-2-yl)acetic acid Traditional Name: 2-(1-amino-2-isopropyl-4,6-diketo-5-mercapto-1,3,5-triazinan-2-yl)acetic acid Formula: C8H14N4O4S MolecularWeight: 262.28616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(NC(=O)N(C(=O)N1N)S)CC(=O)O

Isomeric SMILES

CC(C)C1(NC(=O)N(C(=O)N1N)S)CC(=O)O

InChI

InChI=1S/C8H14N4O4S/c1-4(2)8(3-5(13)14)10-6(15)11(17)7(16)12(8)9/h4,17H,3,9H2,1-2H3,(H,10,15)(H,13,14)