N-[(E)-1-(6-methylpyridazin-3-yl)ethylideneamino]azepane-1-carbothioamide

Systemtic Name: N-[(E)-1-(6-methylpyridazin-3-yl)ethylideneamino]azepane-1-carbothioamide Openeye Name: N-[(E)-1-(6-methylpyridazin-3-yl)ethylideneamino]azepane-1-carbothioamide CAS Name: N-[(E)-1-(6-methyl-3-pyridazinyl)ethylideneamino]-1-azepanecarbothioamide IUPAC Name: N-[(E)-1-(6-methylpyridazin-3-yl)ethylideneamino]azepane-1-carbothioamide Traditional Name: N-[(E)-1-(6-methylpyridazin-3-yl)ethylideneamino]azepane-1-carbothioamide Formula: C14H21N5S MolecularWeight: 291.41504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C=C1)C(=NNC(=S)N2CCCCCC2)C

Isomeric SMILES

CC1=NN=C(C=C1)/C(=N/NC(=S)N2CCCCCC2)/C

InChI

InChI=1S/C14H21N5S/c1-11-7-8-13(17-15-11)12(2)16-18-14(20)19-9-5-3-4-6-10-19/h7-8H,3-6,9-10H2,1-2H3,(H,18,20)/b16-12+