3-[3-oxidanylidene-3-(pyridin-4-ylamino)propyl]sulfanyl-N-pyridin-4-yl-propanamide

Systemtic Name: 3-[3-oxidanylidene-3-(pyridin-4-ylamino)propyl]sulfanyl-N-pyridin-4-yl-propanamide Openeye Name: 3-[3-oxo-3-(4-pyridylamino)propyl]sulfanyl-N-(4-pyridyl)propanamide CAS Name: 3-[[3-oxo-3-(pyridin-4-ylamino)propyl]thio]-N-pyridin-4-ylpropanamide IUPAC Name: 3-[3-oxo-3-(pyridin-4-ylamino)propyl]sulfanyl-N-pyridin-4-ylpropanamide Traditional Name: 3-[[3-keto-3-(4-pyridylamino)propyl]thio]-N-(4-pyridyl)propionamide Formula: C16H18N4O2S MolecularWeight: 330.40472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1NC(=O)CCSCCC(=O)NC2=CC=NC=C2

Isomeric SMILES

C1=CN=CC=C1NC(=O)CCSCCC(=O)NC2=CC=NC=C2

InChI

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