3-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfamoyl]-N-(4-tert-butylphenyl)benzamide

Systemtic Name: 3-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]sulfamoyl]-N-(4-tert-butylphenyl)benzamide Openeye Name: N-(4-tert-butylphenyl)-3-[[(3S)-1,1-dioxothiolan-3-yl]sulfamoyl]benzamide CAS Name: N-(4-tert-butylphenyl)-3-[[(3S)-1,1-dioxo-3-thiolanyl]sulfamoyl]benzamide IUPAC Name: N-(4-tert-butylphenyl)-3-[[(3S)-1,1-dioxothiolan-3-yl]sulfamoyl]benzamide Traditional Name: N-(4-tert-butylphenyl)-3-[[(3S)-1,1-diketothiolan-3-yl]sulfamoyl]benzamide Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C21H26N2O5S2/c1-21(2,3)16-7-9-17(10-8-16)22-20(24)15-5-4-6-19(13-15)30(27,28)23-18-11-12-29(25,26)14-18/h4-10,13,18,23H,11-12,14H2,1-3H3,(H,22,24)/t18-/m0/s1