N-(2,3-dihydro-1,4-benzodioxin-6-yl)azepane-1-carbothioamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)azepane-1-carbothioamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)azepane-1-carbothioamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-azepanecarbothioamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)azepane-1-carbothioamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)azepane-1-carbothioamide Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H20N2O2S/c20-15(17-7-3-1-2-4-8-17)16-12-5-6-13-14(11-12)19-10-9-18-13/h5-6,11H,1-4,7-10H2,(H,16,20)