N-(3-imidazol-1-ylpropyl)-5-methyl-2-oxidanylidene-6-(propan-2-ylideneamino)-4-thia-1,6-diazabicyclo[3.1.0]hexane-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-methyl-2-oxidanylidene-6-(propan-2-ylideneamino)-4-thia-1,6-diazabicyclo[3.1.0]hexane-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-6-(isopropylideneamino)-5-methyl-2-oxo-4-thia-1,6-diazabicyclo[3.1.0]hexane-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-5-methyl-2-oxo-6-(propan-2-ylideneamino)-4-thia-1,6-diazabicyclo[3.1.0]hexane-3-carboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-methyl-2-oxo-6-(propan-2-ylideneamino)-4-thia-1,6-diazabicyclo[3.1.0]hexane-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-6-(isopropylideneamino)-2-keto-5-methyl-4-thia-1,6-diazabicyclo[3.1.0]hexane-3-carboxamide Formula: C14H20N6O2S MolecularWeight: 336.4126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1C2(N1C(=O)C(S2)C(=O)NCCCN3C=CN=C3)C)C

Isomeric SMILES

CC(=NN1C2(N1C(=O)C(S2)C(=O)NCCCN3C=CN=C3)C)C

InChI

InChI=1S/C14H20N6O2S/c1-10(2)17-20-14(3)19(20)13(22)11(23-14)12(21)16-5-4-7-18-8-6-15-9-18/h6,8-9,11H,4-5,7H2,1-3H3,(H,16,21)