3-[acetyloxy-[[(2E)-2-(1-azanylbutan-2-yloxyimino)-2-(2-azanyl-1,3-thiazol-4-yl)ethanoyl]amino]methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride

Systemtic Name: 3-[acetyloxy-[[(2E)-2-(1-azanylbutan-2-yloxyimino)-2-(2-azanyl-1,3-thiazol-4-yl)ethanoyl]amino]methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride Openeye Name: 3-[acetoxy-[[(2E)-2-[1-(aminomethyl)propoxyimino]-2-(2-aminothiazol-4-yl)acetyl]amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride CAS Name: 3-[acetyloxy-[[(2E)-2-(1-aminobutan-2-yloxyimino)-2-(2-amino-4-thiazolyl)-1-oxoethyl]amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride IUPAC Name: 3-[acetyloxy-[[(2E)-2-(1-aminobutan-2-yloxyimino)-2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride Traditional Name: 3-[acetoxy-[[(2E)-2-[1-(aminomethyl)propyloximino]-2-(2-aminothiazol-4-yl)acetyl]amino]methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate dihydrochloride Formula: C19H25Cl2N6O7S2- MolecularWeight: 584.4738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN)ON=C(C1=CSC(=N1)N)C(=O)NC(C2=C(N3C(CC3=O)SC2)C(=O)[O-])OC(=O)C.Cl.Cl

Isomeric SMILES

CCC(CN)O/N=C(\C1=CSC(=N1)N)/C(=O)NC(C2=C(N3C(CC3=O)SC2)C(=O)[O-])OC(=O)C.Cl.Cl

InChI

InChI=1S/C19H24N6O7S2.2ClH/c1-3-9(5-20)32-24-14(11-7-34-19(21)22-11)16(28)23-17(31-8(2)26)10-6-33-13-4-12(27)25(13)15(10)18(29)30;;/h7,9,13,17H,3-6,20H2,1-2H3,(H2,21,22)(H,23,28)(H,29,30);2*1H/p-1/b24-14+;;