3-methyl-8-oxidanylidene-7-[2-[2-[(2-oxidanylidene-3-phenyl-imidazolidin-1-yl)carbonylamino]phenyl]ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-methyl-8-oxidanylidene-7-[2-[2-[(2-oxidanylidene-3-phenyl-imidazolidin-1-yl)carbonylamino]phenyl]ethanoylamino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-methyl-8-oxo-7-[[2-[2-[(2-oxo-3-phenyl-imidazolidine-1-carbonyl)amino]phenyl]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-methyl-8-oxo-7-[[1-oxo-2-[2-[[oxo-(2-oxo-3-phenyl-1-imidazolidinyl)methyl]amino]phenyl]ethyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-methyl-8-oxo-7-[[2-[2-[(2-oxo-3-phenylimidazolidine-1-carbonyl)amino]phenyl]acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[[2-[2-[(2-keto-3-phenyl-imidazolidine-1-carbonyl)amino]phenyl]acetyl]amino]-3-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C26H25N5O6S MolecularWeight: 535.5716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3NC(=O)N4CCN(C4=O)C5=CC=CC=C5)SC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(C(C2=O)NC(=O)CC3=CC=CC=C3NC(=O)N4CCN(C4=O)C5=CC=CC=C5)SC1)C(=O)O

InChI

InChI=1S/C26H25N5O6S/c1-15-14-38-23-20(22(33)31(23)21(15)24(34)35)28-19(32)13-16-7-5-6-10-18(16)27-25(36)30-12-11-29(26(30)37)17-8-3-2-4-9-17/h2-10,20,23H,11-14H2,1H3,(H,27,36)(H,28,32)(H,34,35)