N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2,5-dimethyl-1-(phenylmethyl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-N-(1,1-dioxothiolan-3-yl)-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: N-(1,1-dioxo-3-thiolanyl)-2,5-dimethyl-1-(phenylmethyl)-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-N-(1,1-dioxothiolan-3-yl)-2,5-dimethylpyrrole-3-carboxamide Traditional Name: 1-benzyl-N-(1,1-diketothiolan-3-yl)-2,5-dimethyl-pyrrole-3-carboxamide Formula: C18H22N2O3S MolecularWeight: 346.44388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)NC3CCS(=O)(=O)C3

InChI

InChI=1S/C18H22N2O3S/c1-13-10-17(18(21)19-16-8-9-24(22,23)12-16)14(2)20(13)11-15-6-4-3-5-7-15/h3-7,10,16H,8-9,11-12H2,1-2H3,(H,19,21)