azepan-1-yl(1,3-benzodioxol-5-yl)methanethione

Systemtic Name: azepan-1-yl(1,3-benzodioxol-5-yl)methanethione Openeye Name: azepan-1-yl(1,3-benzodioxol-5-yl)methanethione CAS Name: 1-azepanyl(1,3-benzodioxol-5-yl)methanethione IUPAC Name: azepan-1-yl(1,3-benzodioxol-5-yl)methanethione Traditional Name: azepan-1-yl(1,3-benzodioxol-5-yl)methanethione Formula: C14H17NO2S MolecularWeight: 263.35528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCCN(CC1)C(=S)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H17NO2S/c18-14(15-7-3-1-2-4-8-15)11-5-6-12-13(9-11)17-10-16-12/h5-6,9H,1-4,7-8,10H2