tert-butyl N-[2-[(5-chloranyl-2,4-disulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[(5-chloranyl-2,4-disulfamoyl-phenyl)amino]-2-oxidanylidene-ethyl]carbamate Openeye Name: tert-butyl N-[2-(5-chloro-2,4-disulfamoyl-anilino)-2-oxo-ethyl]carbamate CAS Name: N-[2-(5-chloro-2,4-disulfamoylanilino)-2-oxoethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(5-chloro-2,4-disulfamoylanilino)-2-oxoethyl]carbamate Traditional Name: N-[2-(5-chloro-2,4-disulfamoyl-anilino)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C13H19ClN4O7S2 MolecularWeight: 442.89556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(=O)NC1=CC(=C(C=C1S(=O)(=O)N)S(=O)(=O)N)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC(=O)NC1=CC(=C(C=C1S(=O)(=O)N)S(=O)(=O)N)Cl

InChI

InChI=1S/C13H19ClN4O7S2/c1-13(2,3)25-12(20)17-6-11(19)18-8-4-7(14)9(26(15,21)22)5-10(8)27(16,23)24/h4-5H,6H2,1-3H3,(H,17,20)(H,18,19)(H2,15,21,22)(H2,16,23,24)