2-(2-azanyl-2-oxidanylidene-ethyl)-1-sulfanylidene-3a,4-dihydro-3H-imidazo[5,1-c][1,4]benzoxazine-8-carboxylic acid

Systemtic Name: 2-(2-azanyl-2-oxidanylidene-ethyl)-1-sulfanylidene-3a,4-dihydro-3H-imidazo[5,1-c][1,4]benzoxazine-8-carboxylic acid Openeye Name: 2-(2-amino-2-oxo-ethyl)-1-thioxo-3a,4-dihydro-3H-imidazo[5,1-c][1,4]benzoxazine-8-carboxylic acid CAS Name: 2-(2-amino-2-oxoethyl)-1-sulfanylidene-3a,4-dihydro-3H-imidazo[5,1-c][1,4]benzoxazine-8-carboxylic acid IUPAC Name: 2-(2-amino-2-oxoethyl)-1-sulfanylidene-3a,4-dihydro-3H-imidazo[5,1-c][1,4]benzoxazine-8-carboxylic acid Traditional Name: 2-(2-amino-2-keto-ethyl)-1-thioxo-3a,4-dihydro-3H-imidazo[5,1-c][1,4]benzoxazine-8-carboxylic acid Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

C1C2COC3=C(N2C(=S)N1CC(=O)N)C=C(C=C3)C(=O)O

Isomeric SMILES

C1C2COC3=C(N2C(=S)N1CC(=O)N)C=C(C=C3)C(=O)O

InChI

InChI=1S/C13H13N3O4S/c14-11(17)5-15-4-8-6-20-10-2-1-7(12(18)19)3-9(10)16(8)13(15)21/h1-3,8H,4-6H2,(H2,14,17)(H,18,19)