4-(5-azanyl-1,2,4-thiadiazol-3-yl)-4-[[(2E)-2-methoxyiminoethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 4-(5-azanyl-1,2,4-thiadiazol-3-yl)-4-[[(2E)-2-methoxyiminoethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 4-(5-amino-1,2,4-thiadiazol-3-yl)-4-[[(2E)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 4-(5-amino-1,2,4-thiadiazol-3-yl)-4-[[(2E)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 4-(5-amino-1,2,4-thiadiazol-3-yl)-4-[[(2E)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 4-(5-amino-1,2,4-thiadiazol-3-yl)-8-keto-4-[[(2E)-2-methyloximinoacetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C12H12N6O5S2 MolecularWeight: 384.39088

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Descriptors Computed from Structure

Canonical SMILES:

CON=CC(=O)NC1(C=C(N2C(S1)CC2=O)C(=O)O)C3=NSC(=N3)N

Isomeric SMILES

CO/N=C/C(=O)NC1(C=C(N2C(S1)CC2=O)C(=O)O)C3=NSC(=N3)N

InChI

InChI=1S/C12H12N6O5S2/c1-23-14-4-6(19)16-12(10-15-11(13)25-17-10)3-5(9(21)22)18-7(20)2-8(18)24-12/h3-4,8H,2H2,1H3,(H,16,19)(H,21,22)(H2,13,15,17)/b14-4+