7-[(1-ethyl-5-methyl-pyrazol-4-yl)carbonylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[(1-ethyl-5-methyl-pyrazol-4-yl)carbonylamino]-3-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[(1-ethyl-5-methyl-pyrazole-4-carbonyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[(1-ethyl-5-methyl-4-pyrazolyl)-oxomethyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[(1-ethyl-5-methylpyrazole-4-carbonyl)amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-[(1-ethyl-5-methyl-pyrazole-4-carbonyl)amino]-8-keto-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C(=O)NC2C3N(C2=O)C(=C(CS3)C)C(=O)O)C

Isomeric SMILES

CCN1C(=C(C=N1)C(=O)NC2C3N(C2=O)C(=C(CS3)C)C(=O)O)C

InChI

InChI=1S/C15H18N4O4S/c1-4-18-8(3)9(5-16-18)12(20)17-10-13(21)19-11(15(22)23)7(2)6-24-14(10)19/h5,10,14H,4,6H2,1-3H3,(H,17,20)(H,22,23)