N-(2,3-dihydro-1H-inden-2-yl)azepane-1-carbothioamide

Systemtic Name: N-(2,3-dihydro-1H-inden-2-yl)azepane-1-carbothioamide Openeye Name: N-indan-2-ylazepane-1-carbothioamide CAS Name: N-(2,3-dihydro-1H-inden-2-yl)-1-azepanecarbothioamide IUPAC Name: N-(2,3-dihydro-1H-inden-2-yl)azepane-1-carbothioamide Traditional Name: N-indan-2-ylazepane-1-carbothioamide Formula: C16H22N2S MolecularWeight: 274.42428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2CC3=CC=CC=C3C2

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2CC3=CC=CC=C3C2

InChI

InChI=1S/C16H22N2S/c19-16(18-9-5-1-2-6-10-18)17-15-11-13-7-3-4-8-14(13)12-15/h3-4,7-8,15H,1-2,5-6,9-12H2,(H,17,19)