2-azanyl-3-[[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl]carbonyloxy]propanoic acid

Systemtic Name: 2-azanyl-3-[[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-3-ethenyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl]carbonyloxy]propanoic acid Openeye Name: 2-amino-3-[7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyl]oxy-propanoic acid CAS Name: 2-amino-3-[[7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl]-oxomethoxy]propanoic acid IUPAC Name: 2-amino-3-[7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-ethenyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyl]oxypropanoic acid Traditional Name: 2-amino-3-[7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-8-keto-3-vinyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carbonyl]oxy-propionic acid Formula: C18H20N6O7S2 MolecularWeight: 496.5174

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)C=C)C(=O)OCC(C(=O)O)N

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)C=C)C(=O)OCC(C(=O)O)N

InChI

InChI=1S/C18H20N6O7S2/c1-3-7-5-32-15-11(22-13(25)10(23-30-2)9-6-33-18(20)21-9)14(26)24(15)12(7)17(29)31-4-8(19)16(27)28/h3,6,8,11,15H,1,4-5,19H2,2H3,(H2,20,21)(H,22,25)(H,27,28)/b23-10+