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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=O)CCSCCC(=O)NC2=CN=CC=C2

Isomeric SMILES

C1=CC(=CN=C1)NC(=O)CCSCCC(=O)NC2=CN=CC=C2

InChI

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