N-[(E)-1-phenylethylideneamino]azepane-1-carbothioamide

Systemtic Name: N-[(E)-1-phenylethylideneamino]azepane-1-carbothioamide Openeye Name: N-[(E)-1-phenylethylideneamino]azepane-1-carbothioamide CAS Name: N-[(E)-1-phenylethylideneamino]-1-azepanecarbothioamide IUPAC Name: N-[(E)-1-phenylethylideneamino]azepane-1-carbothioamide Traditional Name: N-[(E)-1-phenylethylideneamino]azepane-1-carbothioamide Formula: C15H21N3S MolecularWeight: 275.41234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=N\NC(=S)N1CCCCCC1)/C2=CC=CC=C2

InChI

InChI=1S/C15H21N3S/c1-13(14-9-5-4-6-10-14)16-17-15(19)18-11-7-2-3-8-12-18/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H,17,19)/b16-13+