2-methylbut-3-en-2-yl 7-methoxy-3-(2-methyl-1-oxidanyl-propyl)-8-oxidanylidene-7-(2-thiophen-3-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate

Systemtic Name: 2-methylbut-3-en-2-yl 7-methoxy-3-(2-methyl-1-oxidanyl-propyl)-8-oxidanylidene-7-(2-thiophen-3-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Openeye Name: 1,1-dimethylallyl 3-(1-hydroxy-2-methyl-propyl)-7-methoxy-8-oxo-7-[[2-(3-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate CAS Name: 3-(1-hydroxy-2-methylpropyl)-7-methoxy-8-oxo-7-[[1-oxo-2-(3-thiophenyl)ethyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid 2-methylbut-3-en-2-yl ester IUPAC Name: 2-methylbut-3-en-2-yl 3-(1-hydroxy-2-methylpropyl)-7-methoxy-8-oxo-7-[(2-thiophen-3-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylate Traditional Name: 3-(1-hydroxy-2-methyl-propyl)-8-keto-7-methoxy-7-[[2-(3-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-3-ene-2-carboxylic acid 1,1-dimethylallyl ester Formula: C23H30N2O6S2 MolecularWeight: 494.6241

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CSC2C(C(=O)N2C1C(=O)OC(C)(C)C=C)(NC(=O)CC3=CSC=C3)OC)O

Isomeric SMILES

CC(C)C(C1=CSC2C(C(=O)N2C1C(=O)OC(C)(C)C=C)(NC(=O)CC3=CSC=C3)OC)O

InChI

InChI=1S/C23H30N2O6S2/c1-7-22(4,5)31-19(28)17-15(18(27)13(2)3)12-33-21-23(30-6,20(29)25(17)21)24-16(26)10-14-8-9-32-11-14/h7-9,11-13,17-18,21,27H,1,10H2,2-6H3,(H,24,26)