sulfamoyl 3-[[bis(azanyl)methylideneamino]methyl]-2-phenyl-cyclohexene-1-carboxylate

Systemtic Name: sulfamoyl 3-[[bis(azanyl)methylideneamino]methyl]-2-phenyl-cyclohexene-1-carboxylate Openeye Name: sulfamoyl 3-(guanidinomethyl)-2-phenyl-cyclohexene-1-carboxylate CAS Name: 3-[(diaminomethylideneamino)methyl]-2-phenyl-1-cyclohexenecarboxylic acid sulfamoyl ester IUPAC Name: sulfamoyl 3-[(diaminomethylideneamino)methyl]-2-phenylcyclohexene-1-carboxylate Traditional Name: 3-(guanidinomethyl)-2-phenyl-cyclohexene-1-carboxylic acid sulfamoyl ester Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=C(C1)C(=O)OS(=O)(=O)N)C2=CC=CC=C2)CN=C(N)N

Isomeric SMILES

C1CC(C(=C(C1)C(=O)OS(=O)(=O)N)C2=CC=CC=C2)CN=C(N)N

InChI

InChI=1S/C15H20N4O4S/c16-15(17)19-9-11-7-4-8-12(14(20)23-24(18,21)22)13(11)10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H4,16,17,19)(H2,18,21,22)