5-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-2-chloranyl-N-(4-cyanophenyl)benzamide

Systemtic Name: 5-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfonyl-2-chloranyl-N-(4-cyanophenyl)benzamide Openeye Name: 2-chloro-N-(4-cyanophenyl)-5-(1,1-dioxothiolan-3-yl)sulfonyl-benzamide CAS Name: 2-chloro-N-(4-cyanophenyl)-5-[(1,1-dioxo-3-thiolanyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-(4-cyanophenyl)-5-(1,1-dioxothiolan-3-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-(4-cyanophenyl)-5-(1,1-diketothiolan-3-yl)sulfonyl-benzamide Formula: C18H15ClN2O5S2 MolecularWeight: 438.9051

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C18H15ClN2O5S2/c19-17-6-5-14(28(25,26)15-7-8-27(23,24)11-15)9-16(17)18(22)21-13-3-1-12(10-20)2-4-13/h1-6,9,15H,7-8,11H2,(H,21,22)