N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]azepane-1-carbothioamide

Systemtic Name: N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]azepane-1-carbothioamide Openeye Name: N-[(E)-[phenyl(2-pyridyl)methylene]amino]azepane-1-carbothioamide CAS Name: N-[(E)-[phenyl(2-pyridinyl)methylidene]amino]-1-azepanecarbothioamide IUPAC Name: N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]azepane-1-carbothioamide Traditional Name: N-[(E)-[phenyl(2-pyridyl)methylene]amino]azepane-1-carbothioamide Formula: C19H22N4S MolecularWeight: 338.46978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NN=C(C2=CC=CC=C2)C3=CC=CC=N3

Isomeric SMILES

C1CCCN(CC1)C(=S)N/N=C(\C2=CC=CC=C2)/C3=CC=CC=N3

InChI

InChI=1S/C19H22N4S/c24-19(23-14-8-1-2-9-15-23)22-21-18(16-10-4-3-5-11-16)17-12-6-7-13-20-17/h3-7,10-13H,1-2,8-9,14-15H2,(H,22,24)/b21-18+