4-[1-azanyl-1,3-bis(oxidanylidene)butan-2-ylidene]-1,3-dithietane-2-carboxylic acid

Systemtic Name: 4-[1-azanyl-1,3-bis(oxidanylidene)butan-2-ylidene]-1,3-dithietane-2-carboxylic acid Openeye Name: 4-(1-carbamoyl-2-oxo-propylidene)-1,3-dithietane-2-carboxylic acid CAS Name: 4-(1-amino-1,3-dioxobutan-2-ylidene)-1,3-dithietane-2-carboxylic acid IUPAC Name: 4-(1-amino-1,3-dioxobutan-2-ylidene)-1,3-dithietane-2-carboxylic acid Traditional Name: 4-(1-carbamoyl-2-keto-propylidene)-1,3-dithietane-2-carboxylic acid Formula: C7H7NO4S2 MolecularWeight: 233.26478

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C1SC(S1)C(=O)O)C(=O)N

Isomeric SMILES

CC(=O)C(=C1SC(S1)C(=O)O)C(=O)N

InChI

InChI=1S/C7H7NO4S2/c1-2(9)3(4(8)10)6-13-7(14-6)5(11)12/h7H,1H3,(H2,8,10)(H,11,12)