3-[[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-phenyl-3-pyridin-2-yl-pyrazol-4-yl]methyl]-N-pyridin-3-yl-benzamide

Systemtic Name: 3-[[1-[1,1-bis(oxidanylidene)thiolan-3-yl]-5-phenyl-3-pyridin-2-yl-pyrazol-4-yl]methyl]-N-pyridin-3-yl-benzamide Openeye Name: 3-[[1-(1,1-dioxothiolan-3-yl)-5-phenyl-3-(2-pyridyl)pyrazol-4-yl]methyl]-N-(3-pyridyl)benzamide CAS Name: 3-[[1-(1,1-dioxo-3-thiolanyl)-5-phenyl-3-(2-pyridinyl)-4-pyrazolyl]methyl]-N-(3-pyridinyl)benzamide IUPAC Name: 3-[[1-(1,1-dioxothiolan-3-yl)-5-phenyl-3-pyridin-2-ylpyrazol-4-yl]methyl]-N-pyridin-3-ylbenzamide Traditional Name: 3-[[1-(1,1-diketothiolan-3-yl)-5-phenyl-3-(2-pyridyl)pyrazol-4-yl]methyl]-N-(3-pyridyl)benzamide Formula: C31H27N5O3S MolecularWeight: 549.64278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2C(=C(C(=N2)C3=CC=CC=N3)CC4=CC=CC(=C4)C(=O)NC5=CN=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CS(=O)(=O)CC1N2C(=C(C(=N2)C3=CC=CC=N3)CC4=CC=CC(=C4)C(=O)NC5=CN=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H27N5O3S/c37-31(34-25-12-7-15-32-20-25)24-11-6-8-22(18-24)19-27-29(28-13-4-5-16-33-28)35-36(26-14-17-40(38,39)21-26)30(27)23-9-2-1-3-10-23/h1-13,15-16,18,20,26H,14,17,19,21H2,(H,34,37)