N-(phenylmethyl)azepane-1-carbothioamide

Systemtic Name: N-(phenylmethyl)azepane-1-carbothioamide Openeye Name: N-benzylazepane-1-carbothioamide CAS Name: N-(phenylmethyl)-1-azepanecarbothioamide IUPAC Name: N-benzylazepane-1-carbothioamide Traditional Name: N-benzylazepane-1-carbothioamide Formula: C14H20N2S MolecularWeight: 248.387

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C14H20N2S/c17-14(16-10-6-1-2-7-11-16)15-12-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2,(H,15,17)