4-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]benzenesulfonamide Openeye Name: 4-[[3,4-dioxo-2-(1,2,2-trimethylpropylamino)cyclobuten-1-yl]amino]benzenesulfonamide CAS Name: 4-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-dioxo-1-cyclobutenyl]amino]benzenesulfonamide IUPAC Name: 4-[[2-(3,3-dimethylbutan-2-ylamino)-3,4-dioxocyclobuten-1-yl]amino]benzenesulfonamide Traditional Name: 4-[[3,4-diketo-2-(1,2,2-trimethylpropylamino)cyclobuten-1-yl]amino]benzenesulfonamide Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C16H21N3O4S/c1-9(16(2,3)4)18-12-13(15(21)14(12)20)19-10-5-7-11(8-6-10)24(17,22)23/h5-9,18-19H,1-4H3,(H2,17,22,23)