tert-butyl N-[4-oxidanylidene-4-[[4-(2-sulfamoylhexan-3-yl)phenyl]amino]butyl]carbamate

Systemtic Name: tert-butyl N-[4-oxidanylidene-4-[[4-(2-sulfamoylhexan-3-yl)phenyl]amino]butyl]carbamate Openeye Name: tert-butyl N-[4-oxo-4-[4-[1-(1-sulfamoylethyl)butyl]anilino]butyl]carbamate CAS Name: N-[4-oxo-4-[4-(2-sulfamoylhexan-3-yl)anilino]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-oxo-4-[4-(2-sulfamoylhexan-3-yl)anilino]butyl]carbamate Traditional Name: N-[4-keto-4-[4-[1-(1-sulfamoylethyl)butyl]anilino]butyl]carbamic acid tert-butyl ester Formula: C21H35N3O5S MolecularWeight: 441.5847

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)NC(=O)CCCNC(=O)OC(C)(C)C)C(C)S(=O)(=O)N

Isomeric SMILES

CCCC(C1=CC=C(C=C1)NC(=O)CCCNC(=O)OC(C)(C)C)C(C)S(=O)(=O)N

InChI

InChI=1S/C21H35N3O5S/c1-6-8-18(15(2)30(22,27)28)16-10-12-17(13-11-16)24-19(25)9-7-14-23-20(26)29-21(3,4)5/h10-13,15,18H,6-9,14H2,1-5H3,(H,23,26)(H,24,25)(H2,22,27,28)