N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-[2-[(4-ethylphenyl)methyl]-3-pyrazolyl]-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-[2-[(4-ethylphenyl)methyl]pyrazol-3-yl]-1,1-dioxothiolane-3-carboxamide Traditional Name: N-[2-(4-ethylbenzyl)pyrazol-3-yl]-1,1-diketo-thiolane-3-carboxamide Formula: C17H21N3O3S MolecularWeight: 347.43194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCS(=O)(=O)C3

Isomeric SMILES

CCC1=CC=C(C=C1)CN2C(=CC=N2)NC(=O)C3CCS(=O)(=O)C3

InChI

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