3-(azepan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2-thione

Systemtic Name: 3-(azepan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2-thione Openeye Name: 3-(azepan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2-thione CAS Name: 3-(1-azepanyl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2-thione IUPAC Name: 3-(azepan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2-thione Traditional Name: 3-(azepan-1-yl)-4,5,6,7-tetrahydro-1,3-benzothiazole-2-thione Formula: C13H20N2S2 MolecularWeight: 268.4413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)N2C3=C(CCCC3)SC2=S

Isomeric SMILES

C1CCCN(CC1)N2C3=C(CCCC3)SC2=S

InChI

InChI=1S/C13H20N2S2/c16-13-15(14-9-5-1-2-6-10-14)11-7-3-4-8-12(11)17-13/h1-10H2