2-(4-bromophenyl)sulfanyl-N-[2-(furan-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-(4-bromophenyl)sulfanyl-N-[2-(furan-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide Openeye Name: 2-(4-bromophenyl)sulfanyl-N-[2-(2-furylmethyl)pyrazol-3-yl]pyridine-3-carboxamide CAS Name: 2-[(4-bromophenyl)thio]-N-[2-(2-furanylmethyl)-3-pyrazolyl]-3-pyridinecarboxamide IUPAC Name: 2-(4-bromophenyl)sulfanyl-N-[2-(furan-2-ylmethyl)pyrazol-3-yl]pyridine-3-carboxamide Traditional Name: 2-[(4-bromophenyl)thio]-N-[2-(2-furfuryl)pyrazol-3-yl]nicotinamide Formula: C20H15BrN4O2S MolecularWeight: 455.3277

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=CC=C(C=C2)Br)C(=O)NC3=CC=NN3CC4=CC=CO4

Isomeric SMILES

C1=CC(=C(N=C1)SC2=CC=C(C=C2)Br)C(=O)NC3=CC=NN3CC4=CC=CO4

InChI

InChI=1S/C20H15BrN4O2S/c21-14-5-7-16(8-6-14)28-20-17(4-1-10-22-20)19(26)24-18-9-11-23-25(18)13-15-3-2-12-27-15/h1-12H,13H2,(H,24,26)