N-phenylazepane-1-carbothioamide

Systemtic Name: N-phenylazepane-1-carbothioamide Openeye Name: N-phenylazepane-1-carbothioamide CAS Name: N-phenyl-1-azepanecarbothioamide IUPAC Name: N-phenylazepane-1-carbothioamide Traditional Name: N-phenylazepane-1-carbothioamide Formula: C13H18N2S MolecularWeight: 234.36042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=CC=CC=C2

InChI

InChI=1S/C13H18N2S/c16-13(14-12-8-4-3-5-9-12)15-10-6-1-2-7-11-15/h3-5,8-9H,1-2,6-7,10-11H2,(H,14,16)