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

Systemtic Name: N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-2,5-dimethyl-1-pyridin-2-yl-pyrrole-3-carboxamide Openeye Name: N-[(1,1-dioxothiolan-3-yl)methyl]-2,5-dimethyl-1-(2-pyridyl)pyrrole-3-carboxamide CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]-2,5-dimethyl-1-(2-pyridinyl)-3-pyrrolecarboxamide IUPAC Name: N-[(1,1-dioxothiolan-3-yl)methyl]-2,5-dimethyl-1-pyridin-2-ylpyrrole-3-carboxamide Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]-2,5-dimethyl-1-(2-pyridyl)pyrrole-3-carboxamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=N2)C)C(=O)NCC3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=N2)C)C(=O)NCC3CCS(=O)(=O)C3

InChI

InChI=1S/C17H21N3O3S/c1-12-9-15(13(2)20(12)16-5-3-4-7-18-16)17(21)19-10-14-6-8-24(22,23)11-14/h3-5,7,9,14H,6,8,10-11H2,1-2H3,(H,19,21)