2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanyl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanyl-N-(3-pyridylmethyl)pyridine-3-carboxamide CAS Name: 2-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-N-(3-pyridinylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanyl-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-[(2-cumidino-2-keto-ethyl)thio]-N-(3-pyridylmethyl)nicotinamide Formula: C23H24N4O2S MolecularWeight: 420.52726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C23H24N4O2S/c1-16(2)18-7-9-19(10-8-18)27-21(28)15-30-23-20(6-4-12-25-23)22(29)26-14-17-5-3-11-24-13-17/h3-13,16H,14-15H2,1-2H3,(H,26,29)(H,27,28)