4-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]butanoic acid

Systemtic Name: 4-[[4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]butanoic acid Openeye Name: 4-[(4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]butanoic acid CAS Name: 4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]butanoic acid IUPAC Name: 4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methylamino]butanoic acid Traditional Name: 4-[(4,6-diketo-2-thioxo-hexahydropyrimidin-5-ylidene)methylamino]butyric acid Formula: C9H11N3O4S MolecularWeight: 257.26634

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)O)CNC=C1C(=O)NC(=S)NC1=O

Isomeric SMILES

C(CC(=O)O)CNC=C1C(=O)NC(=S)NC1=O

InChI

InChI=1S/C9H11N3O4S/c13-6(14)2-1-3-10-4-5-7(15)11-9(17)12-8(5)16/h4,10H,1-3H2,(H,13,14)(H2,11,12,15,16,17)