3,3-dimethyl-N-[3-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]sulfanylphenyl]butanamide

Systemtic Name: 3,3-dimethyl-N-[3-[1-oxidanylidene-1-[(4-sulfamoylphenyl)amino]propan-2-yl]sulfanylphenyl]butanamide Openeye Name: 3,3-dimethyl-N-[3-[1-methyl-2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylphenyl]butanamide CAS Name: 3,3-dimethyl-N-[3-[[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]thio]phenyl]butanamide IUPAC Name: 3,3-dimethyl-N-[3-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]sulfanylphenyl]butanamide Traditional Name: N-[3-[[2-keto-1-methyl-2-(4-sulfamoylanilino)ethyl]thio]phenyl]-3,3-dimethyl-butyramide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)CC(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N)SC2=CC=CC(=C2)NC(=O)CC(C)(C)C

InChI

InChI=1S/C21H27N3O4S2/c1-14(20(26)24-15-8-10-18(11-9-15)30(22,27)28)29-17-7-5-6-16(12-17)23-19(25)13-21(2,3)4/h5-12,14H,13H2,1-4H3,(H,23,25)(H,24,26)(H2,22,27,28)