N-(thiophen-2-ylmethyl)azepane-1-carbothioamide

Systemtic Name: N-(thiophen-2-ylmethyl)azepane-1-carbothioamide Openeye Name: N-(2-thienylmethyl)azepane-1-carbothioamide CAS Name: N-(thiophen-2-ylmethyl)-1-azepanecarbothioamide IUPAC Name: N-(thiophen-2-ylmethyl)azepane-1-carbothioamide Traditional Name: N-(2-thenyl)azepane-1-carbothioamide Formula: C12H18N2S2 MolecularWeight: 254.41472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NCC2=CC=CS2

Isomeric SMILES

C1CCCN(CC1)C(=S)NCC2=CC=CS2

InChI

InChI=1S/C12H18N2S2/c15-12(13-10-11-6-5-9-16-11)14-7-3-1-2-4-8-14/h5-6,9H,1-4,7-8,10H2,(H,13,15)