[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino] 3-(1-methoxycarbonylcyclopropyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: [[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino] 3-(1-methoxycarbonylcyclopropyl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: [[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino] 3-(1-methoxycarbonylcyclopropyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(1-methoxycarbonylcyclopropyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid [[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino] ester IUPAC Name: [[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino] 3-(1-methoxycarbonylcyclopropyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(1-carbomethoxycyclopropyl)-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid [[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino] ester Formula: C18H19N5O7S2 MolecularWeight: 481.50276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CC1)C2=C(N3C(CC3=O)SC2)C(=O)ONC(=O)C(=NOC)C4=CSC(=N4)N

Isomeric SMILES

COC(=O)C1(CC1)C2=C(N3C(CC3=O)SC2)C(=O)ONC(=O)/C(=N/OC)/C4=CSC(=N4)N

InChI

InChI=1S/C18H19N5O7S2/c1-28-16(27)18(3-4-18)8-6-31-11-5-10(24)23(11)13(8)15(26)30-22-14(25)12(21-29-2)9-7-32-17(19)20-9/h7,11H,3-6H2,1-2H3,(H2,19,20)(H,22,25)/b21-12+