sodium 3-(acetyloxymethyl)-7-[2-[3-[[3-[(E)-(3-methylphenyl)methylideneamino]-2-oxidanylidene-imidazolidin-1-yl]carbonylamino]phenyl]ethanoylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: sodium 3-(acetyloxymethyl)-7-[2-[3-[[3-[(E)-(3-methylphenyl)methylideneamino]-2-oxidanylidene-imidazolidin-1-yl]carbonylamino]phenyl]ethanoylamino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: sodium 3-(acetoxymethyl)-7-[[2-[3-[[3-[(E)-m-tolylmethyleneamino]-2-oxo-imidazolidine-1-carbonyl]amino]phenyl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: sodium 3-(acetyloxymethyl)-7-[[2-[3-[[[3-[(E)-(3-methylphenyl)methylideneamino]-2-oxo-1-imidazolidinyl]-oxomethyl]amino]phenyl]-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: sodium 3-(acetyloxymethyl)-7-[[2-[3-[[3-[(E)-(3-methylphenyl)methylideneamino]-2-oxoimidazolidine-1-carbonyl]amino]phenyl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: sodium 3-(acetoxymethyl)-8-keto-7-[[2-[3-[[2-keto-3-[(E)-(3-methylbenzylidene)amino]imidazolidine-1-carbonyl]amino]phenyl]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C30H29N6NaO8S MolecularWeight: 656.64143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=NN2CCN(C2=O)C(=O)NC3=CC=CC(=C3)CC(=O)NC4C5N(C4=O)C(=C(CS5)COC(=O)C)C(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC=CC(=C1)/C=N/N2CCN(C2=O)C(=O)NC3=CC=CC(=C3)CC(=O)NC4C5N(C4=O)C(=C(CS5)COC(=O)C)C(=O)[O-].[Na+]

InChI

InChI=1S/C30H30N6O8S.Na/c1-17-5-3-7-20(11-17)14-31-35-10-9-34(30(35)43)29(42)32-22-8-4-6-19(12-22)13-23(38)33-24-26(39)36-25(28(40)41)21(15-44-18(2)37)16-45-27(24)36;/h3-8,11-12,14,24,27H,9-10,13,15-16H2,1-2H3,(H,32,42)(H,33,38)(H,40,41);/q;+1/p-1/b31-14+;