[5-(4-dimethylaminophenyl)-7-pyridin-3-ylcarbonyl-imidazo[5,1-b][1,3]thiazol-2-yl] 6-(1-hydroxyethyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: [5-(4-dimethylaminophenyl)-7-pyridin-3-ylcarbonyl-imidazo[5,1-b][1,3]thiazol-2-yl] 6-(1-hydroxyethyl)-4-methyl-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: [5-(4-dimethylaminophenyl)-7-(pyridine-3-carbonyl)imidazo[5,1-b]thiazol-2-yl] 6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: 6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid [5-(4-dimethylaminophenyl)-7-[oxo(3-pyridinyl)methyl]-2-imidazo[5,1-b]thiazolyl] ester IUPAC Name: [5-(4-dimethylaminophenyl)-7-(pyridine-3-carbonyl)imidazo[5,1-b][1,3]thiazol-2-yl] 6-(1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: 6-(1-hydroxyethyl)-7-keto-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid [5-(4-dimethylaminophenyl)-7-nicotinoyl-imidazo[5,1-b]thiazol-2-yl] ester Formula: C29H27N5O5S MolecularWeight: 557.62018

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(N2C1C(C2=O)C(C)O)C(=O)OC3=CN4C(=C(N=C4C5=CC=C(C=C5)N(C)C)C(=O)C6=CN=CC=C6)S3

Isomeric SMILES

CC1C=C(N2C1C(C2=O)C(C)O)C(=O)OC3=CN4C(=C(N=C4C5=CC=C(C=C5)N(C)C)C(=O)C6=CN=CC=C6)S3

InChI

InChI=1S/C29H27N5O5S/c1-15-12-20(34-24(15)22(16(2)35)27(34)37)29(38)39-21-14-33-26(17-7-9-19(10-8-17)32(3)4)31-23(28(33)40-21)25(36)18-6-5-11-30-13-18/h5-16,22,24,35H,1-4H3