N-[(Z)-1-pyridin-2-ylbutylideneamino]azepane-1-carbothioamide

Systemtic Name: N-[(Z)-1-pyridin-2-ylbutylideneamino]azepane-1-carbothioamide Openeye Name: N-[(Z)-1-(2-pyridyl)butylideneamino]azepane-1-carbothioamide CAS Name: N-[(Z)-1-(2-pyridinyl)butylideneamino]-1-azepanecarbothioamide IUPAC Name: N-[(Z)-1-pyridin-2-ylbutylideneamino]azepane-1-carbothioamide Traditional Name: N-[(Z)-1-(2-pyridyl)butylideneamino]azepane-1-carbothioamide Formula: C16H24N4S MolecularWeight: 304.45356

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=S)N1CCCCCC1)C2=CC=CC=N2

Isomeric SMILES

CCC/C(=N/NC(=S)N1CCCCCC1)/C2=CC=CC=N2

InChI

InChI=1S/C16H24N4S/c1-2-9-15(14-10-5-6-11-17-14)18-19-16(21)20-12-7-3-4-8-13-20/h5-6,10-11H,2-4,7-9,12-13H2,1H3,(H,19,21)/b18-15-