1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(2-chlorophenyl)methyl]-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: 1-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(2-chlorophenyl)methyl]-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-(1,1-dioxo-3-thiolanyl)-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-(1,1-dioxothiolan-3-yl)-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-(1,1-diketothiolan-3-yl)-5-(2-thienyl)pyrazole-3-carboxamide Formula: C19H18ClN3O3S2 MolecularWeight: 435.94752

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=CC(=N2)C(=O)NCC3=CC=CC=C3Cl)C4=CC=CS4

Isomeric SMILES

C1CS(=O)(=O)CC1N2C(=CC(=N2)C(=O)NCC3=CC=CC=C3Cl)C4=CC=CS4

InChI

InChI=1S/C19H18ClN3O3S2/c20-15-5-2-1-4-13(15)11-21-19(24)16-10-17(18-6-3-8-27-18)23(22-16)14-7-9-28(25,26)12-14/h1-6,8,10,14H,7,9,11-12H2,(H,21,24)