N-[[azanyl(1,2-dihydropyridin-6-yl)methylidene]amino]azepane-1-carbothioamide

Systemtic Name: N-[[azanyl(1,2-dihydropyridin-6-yl)methylidene]amino]azepane-1-carbothioamide Openeye Name: N-[[amino(1,2-dihydropyridin-6-yl)methylene]amino]azepane-1-carbothioamide CAS Name: N-[[amino(1,2-dihydropyridin-6-yl)methylidene]amino]-1-azepanecarbothioamide IUPAC Name: N-[[amino(1,2-dihydropyridin-6-yl)methylidene]amino]azepane-1-carbothioamide Traditional Name: N-[[amino(1,2-dihydropyridin-6-yl)methylene]amino]azepane-1-carbothioamide Formula: C13H21N5S MolecularWeight: 279.40434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NN=C(C2=CC=CCN2)N

Isomeric SMILES

C1CCCN(CC1)C(=S)NN=C(C2=CC=CCN2)N

InChI

InChI=1S/C13H21N5S/c14-12(11-7-3-4-8-15-11)16-17-13(19)18-9-5-1-2-6-10-18/h3-4,7,15H,1-2,5-6,8-10H2,(H2,14,16)(H,17,19)