4-(pyridin-4-ylmethylamino)quinoline-3-carbothioamide

Systemtic Name: 4-(pyridin-4-ylmethylamino)quinoline-3-carbothioamide Openeye Name: 4-(4-pyridylmethylamino)quinoline-3-carbothioamide CAS Name: 4-(pyridin-4-ylmethylamino)-3-quinolinecarbothioamide IUPAC Name: 4-(pyridin-4-ylmethylamino)quinoline-3-carbothioamide Traditional Name: 4-(4-pyridylmethylamino)quinoline-3-carbothioamide Formula: C16H14N4S MolecularWeight: 294.37416

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C=N2)C(=S)N)NCC3=CC=NC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C=N2)C(=S)N)NCC3=CC=NC=C3

InChI

InChI=1S/C16H14N4S/c17-16(21)13-10-19-14-4-2-1-3-12(14)15(13)20-9-11-5-7-18-8-6-11/h1-8,10H,9H2,(H2,17,21)(H,19,20)