[4-(butan-2-ylsulfamoyl)phenyl] 4-[bis(azanyl)methylideneamino]benzoate

Systemtic Name: [4-(butan-2-ylsulfamoyl)phenyl] 4-[bis(azanyl)methylideneamino]benzoate Openeye Name: [4-(sec-butylsulfamoyl)phenyl] 4-guanidinobenzoate CAS Name: 4-(diaminomethylideneamino)benzoic acid [4-(butan-2-ylsulfamoyl)phenyl] ester IUPAC Name: [4-(butan-2-ylsulfamoyl)phenyl] 4-(diaminomethylideneamino)benzoate Traditional Name: 4-guanidinobenzoic acid [4-(sec-butylsulfamoyl)phenyl] ester Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C18H22N4O4S/c1-3-12(2)22-27(24,25)16-10-8-15(9-11-16)26-17(23)13-4-6-14(7-5-13)21-18(19)20/h4-12,22H,3H2,1-2H3,(H4,19,20,21)