6-[2,2-diethyl-4-(3-hydroxyphenyl)-5-oxidanylidene-imidazolidin-1-yl]-3,3-dimethyl-2-(2H-1,2,3,4-tetrazol-5-yl)-4-thia-1-azabicyclo[3.2.0]heptan-7-one

Systemtic Name: 6-[2,2-diethyl-4-(3-hydroxyphenyl)-5-oxidanylidene-imidazolidin-1-yl]-3,3-dimethyl-2-(2H-1,2,3,4-tetrazol-5-yl)-4-thia-1-azabicyclo[3.2.0]heptan-7-one Openeye Name: 6-[2,2-diethyl-4-(3-hydroxyphenyl)-5-oxo-imidazolidin-1-yl]-3,3-dimethyl-2-(2H-tetrazol-5-yl)-4-thia-1-azabicyclo[3.2.0]heptan-7-one CAS Name: 6-[2,2-diethyl-4-(3-hydroxyphenyl)-5-oxo-1-imidazolidinyl]-3,3-dimethyl-2-(2H-tetrazol-5-yl)-4-thia-1-azabicyclo[3.2.0]heptan-7-one IUPAC Name: 6-[2,2-diethyl-4-(3-hydroxyphenyl)-5-oxoimidazolidin-1-yl]-3,3-dimethyl-2-(2H-tetrazol-5-yl)-4-thia-1-azabicyclo[3.2.0]heptan-7-one Traditional Name: 6-[2,2-diethyl-4-(3-hydroxyphenyl)-5-keto-imidazolidin-1-yl]-3,3-dimethyl-2-(2H-tetrazol-5-yl)-4-thia-1-azabicyclo[3.2.0]heptan-7-one Formula: C21H27N7O3S MolecularWeight: 457.54918

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(NC(C(=O)N1C2C3N(C2=O)C(C(S3)(C)C)C4=NNN=N4)C5=CC(=CC=C5)O)CC

Isomeric SMILES

CCC1(NC(C(=O)N1C2C3N(C2=O)C(C(S3)(C)C)C4=NNN=N4)C5=CC(=CC=C5)O)CC

InChI

InChI=1S/C21H27N7O3S/c1-5-21(6-2)22-13(11-8-7-9-12(29)10-11)17(30)28(21)14-18(31)27-15(16-23-25-26-24-16)20(3,4)32-19(14)27/h7-10,13-15,19,22,29H,5-6H2,1-4H3,(H,23,24,25,26)