sodium (6E)-7-oxidanylidene-6-[[7-(phenylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methylidene]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Systemtic Name: sodium (6E)-7-oxidanylidene-6-[[7-(phenylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methylidene]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Openeye Name: sodium (6E)-6-[(7-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methylene]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate CAS Name: sodium (6E)-7-oxo-6-[[7-(phenylmethyl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]methylidene]-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate IUPAC Name: sodium (6E)-6-[(7-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methylidene]-7-oxo-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Traditional Name: sodium (6E)-6-[(7-benzyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)methylene]-7-keto-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate Formula: C20H17N4NaO3S MolecularWeight: 416.42875

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2C=C(N=C2CN1CC3=CC=CC=C3)C=C4C5N(C4=O)C(=CS5)C(=O)[O-].[Na+]

Isomeric SMILES

C1CN2C=C(N=C2CN1CC3=CC=CC=C3)/C=C\4/C5N(C4=O)C(=CS5)C(=O)[O-].[Na+]

InChI

InChI=1S/C20H18N4O3S.Na/c25-18-15(19-24(18)16(12-28-19)20(26)27)8-14-10-23-7-6-22(11-17(23)21-14)9-13-4-2-1-3-5-13;/h1-5,8,10,12,19H,6-7,9,11H2,(H,26,27);/q;+1/p-1/b15-8+;