3-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]sulfanyl-N-pyridin-2-yl-propanamide

Systemtic Name: 3-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]sulfanyl-N-pyridin-2-yl-propanamide Openeye Name: 3-[3-oxo-3-(2-pyridylamino)propyl]sulfanyl-N-(2-pyridyl)propanamide CAS Name: 3-[[3-oxo-3-(2-pyridinylamino)propyl]thio]-N-(2-pyridinyl)propanamide IUPAC Name: 3-[3-oxo-3-(pyridin-2-ylamino)propyl]sulfanyl-N-pyridin-2-ylpropanamide Traditional Name: 3-[[3-keto-3-(2-pyridylamino)propyl]thio]-N-(2-pyridyl)propionamide Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=O)CCSCCC(=O)NC2=CC=CC=N2

Isomeric SMILES

C1=CC=NC(=C1)NC(=O)CCSCCC(=O)NC2=CC=CC=N2

InChI

InChI=1S/C16H18N4O2S/c21-15(19-13-5-1-3-9-17-13)7-11-23-12-8-16(22)20-14-6-2-4-10-18-14/h1-6,9-10H,7-8,11-12H2,(H,17,19,21)(H,18,20,22)