2-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(furan-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(furan-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[2-(2,4-dimethoxyanilino)-2-oxo-ethyl]sulfanyl-N-(2-furylmethyl)pyridine-3-carboxamide CAS Name: 2-[[2-(2,4-dimethoxyanilino)-2-oxoethyl]thio]-N-(2-furanylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(furan-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-[[2-(2,4-dimethoxyanilino)-2-keto-ethyl]thio]-N-(2-furfuryl)nicotinamide Formula: C21H21N3O5S MolecularWeight: 427.47354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CO3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)NCC3=CC=CO3)OC

InChI

InChI=1S/C21H21N3O5S/c1-27-14-7-8-17(18(11-14)28-2)24-19(25)13-30-21-16(6-3-9-22-21)20(26)23-12-15-5-4-10-29-15/h3-11H,12-13H2,1-2H3,(H,23,26)(H,24,25)