6-(1-pyridin-3-ylethylamino)pyridine-3-carbothioamide

Systemtic Name: 6-(1-pyridin-3-ylethylamino)pyridine-3-carbothioamide Openeye Name: 6-[1-(3-pyridyl)ethylamino]pyridine-3-carbothioamide CAS Name: 6-[1-(3-pyridinyl)ethylamino]-3-pyridinecarbothioamide IUPAC Name: 6-(1-pyridin-3-ylethylamino)pyridine-3-carbothioamide Traditional Name: 6-[1-(3-pyridyl)ethylamino]thionicotinamide Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)NC2=NC=C(C=C2)C(=S)N

Isomeric SMILES

CC(C1=CN=CC=C1)NC2=NC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H14N4S/c1-9(10-3-2-6-15-7-10)17-12-5-4-11(8-16-12)13(14)18/h2-9H,1H3,(H2,14,18)(H,16,17)