3-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]sulfanyl-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: 3-[3-oxidanylidene-3-(pyridin-2-ylmethylamino)propyl]sulfanyl-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-[3-oxo-3-(2-pyridylmethylamino)propyl]sulfanyl-N-(2-pyridylmethyl)propanamide CAS Name: 3-[[3-oxo-3-(2-pyridinylmethylamino)propyl]thio]-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-[3-oxo-3-(pyridin-2-ylmethylamino)propyl]sulfanyl-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-[[3-keto-3-(2-pyridylmethylamino)propyl]thio]-N-(2-pyridylmethyl)propionamide Formula: C18H22N4O2S MolecularWeight: 358.45788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CNC(=O)CCSCCC(=O)NCC2=CC=CC=N2

Isomeric SMILES

C1=CC=NC(=C1)CNC(=O)CCSCCC(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C18H22N4O2S/c23-17(21-13-15-5-1-3-9-19-15)7-11-25-12-8-18(24)22-14-16-6-2-4-10-20-16/h1-6,9-10H,7-8,11-14H2,(H,21,23)(H,22,24)